Company lists · Data refreshed November 2026
Top 25 Computational drug discovery companies worldwide
RevenueBase identified 1,442 company matches for computational drug discovery companies worldwide as of November 2026 and tracks 35,304 professional contacts across them, including 14,864 with verified work emails. The United States is the largest market and Cambridge the largest hub.
This list covers company matches for computational drug discovery companies worldwide, found by RevenueBase SmartSearch using the meaning of business descriptions in its company graph at Exact. Ranked by professionals tracked, largest first. Rows show recorded descriptions where available, Exact search membership and the snapshot date. Data refreshed November 6, 2026. Country and city lists for computational drug discovery companies follow the table.
Published by RevenueBase, a B2B data infrastructure company. This list was built with RevenueBase SmartSearch, the natural-language company search RevenueBase customers use to build their own targeted lists and unlock verified emails and direct dials at the companies on them. How these lists are built and judged.
The 25 largest computational drug discovery companies worldwide
Ranked by team size| # | Company | Contacts | |||
|---|---|---|---|---|---|
| 1 | 3,120 contacts → | ||||
Exact match “Evotec is a biotechnology company that is committed to advancing drug discovery and development.” Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase | |||||
| 2 | 2,002 contacts → | ||||
Exact match “ArisGlobal is an AI-first technology company at the forefront of life sciences and the creator of LifeSphere®, the platform trusted by hundreds of life sciences organizations…” Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase | |||||
| 3 | 1,214 contacts → | ||||
Exact match “Certara accelerates medicines using proprietary biosimulation software, technology and services to transform traditional drug discovery and development.” Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase | |||||
| 4 | 1,069 contacts → | ||||
Exact match “TCG Lifesciences Pvt.” Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase | |||||
| 5 | 979 contacts → | ||||
Exact match “Schrödinger’s industry-leading computational platform facilitates the research efforts of biopharmaceutical and industrial companies, academic institutions, and government…” Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase | |||||
| 6 | 943 contacts → | ||||
Exact match “Discover how Excelra, a leader in biopharma data and analytics, uniquely blends scientific understanding with technological expertise.” Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase | |||||
| 7 | 678 contacts → | ||||
Exact match “Aptuit, an Evotec company, is a pharmaceutical services provider that offers the most complete set of integrated early discovery to mid-phase drug development solutions by…” Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase | |||||
| 8 | 536 contacts → | ||||
Exact match “Founded in 2005, o2h discovery is a Contract Research Organisation which has an integrated drug discovery platform operating from our state-of-the-art research centre in India and…” Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase | |||||
| 9 | 450 contacts → | ||||
Exact match “Isomorphic Labs is here to advance human health by building on and beyond the Nobel-winning AlphaFold system.” Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase | |||||
| 10 | 439 contacts → | ||||
Exact match “We founded Precision Medicine Group in 2012 because we believed there was a transformational opportunity to improve the process of bringing new drugs to market.” Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase | |||||
| 11 | 417 contacts → | ||||
Exact match “Genedata transforms biopharma data into intelligence.” Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase | |||||
| 12 | 379 contacts → | ||||
Exact match “Enveda is a biotechnology company that is learning from life’s chemistry to create better medicines faster.” Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase | |||||
| 13 | 366 contacts → | ||||
Exact match “Jubilant Chemsys Ltd (JCL); a company registered under the Indian Companies Act, 1956 offers services in synthetic, organic and medicinal chemistry areas to various pharmaceutical…” Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase | |||||
| 14 | 353 contacts → | ||||
Exact match “Novalix is a premier drug discovery partner to biotech firms and pharmaceutical companies.” Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase | |||||
| 15 | 346 contacts → | ||||
Exact match “We develop and apply fragment and structure-based methods to solve problems in drug discovery, and have generated cell active lead compounds and development candidates against…” Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase | |||||
| 16 | 295 contacts → | ||||
Exact match “Insilico Medicine, a clinical stage biotech company powered by generative AI, is connecting biology, chemistry, and clinical trials analysis using next-generation AI systems.” Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase | |||||
| 17 | 259 contacts → | ||||
Exact match Recorded description not available. Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase | |||||
| 18 | 257 contacts → | ||||
Exact match “We are a quantum physics-based, AI-powered drug R&D company with the mission to revolutionize drug discovery and development by improving the speed, scale, novelty and success…” Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase | |||||
| 19 | 220 contacts → | ||||
Exact match “At PI Health Sciences, we provide fully integrated drug discovery solutions, combining synthetic and medicinal chemistry, biology, and AI-driven technologies.” Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase | |||||
| 20 | 210 contacts → | ||||
Exact match “Xaira Therapeutics is an integrated biotechnology company driving advances in artificial intelligence to learn the language of life and transform how we treat disease.” Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase | |||||
| 21 | 209 contacts → | ||||
Exact match “Premas is developing transformational technologies and partnering with pharmaceutical companies around the world to expedite their drug discovery programs by cutting down…” Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase | |||||
| 22 | 208 contacts → | ||||
Exact match “Founded in Cyprotex has grown to become an industry leader in in vitro and in silico ADME-Tox.” Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase | |||||
| 23 | 204 contacts → | ||||
Exact match “Valo is a technology company built to transform drug discovery and development using large-scale data and AI-powered computation.” Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase | |||||
| 24 | 200 contacts → | ||||
Exact match “Simulations Plus is a leading provider of modeling and simulation software and consulting services supporting drug discovery, development research, and regulatory submissions.” Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase | |||||
| 25 | 197 contacts → | ||||
Exact match “Formation Bio is an AI-native pharma company differentiated by radically more efficient drug development.” Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase | |||||
RevenueBase SmartSearch
Describe a niche business in your own words. RevenueBase SmartSearch compares the meaning of your description with company business descriptions compiled in the RevenueBase company graph. Exact, Similar, Related and Broad control how closely companies must fit.
This list uses Exact for “computational drug discovery companies”. Each Exact match badge shows membership in that saved search; it is not an individual similarity score or a service-quality rating. Recorded descriptions are shown where available.
Showing 25 of 1,442 computational drug discovery companies worldwide
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Computational drug discovery companies worldwide at a glance
As of Nov 6, 2026Companies by employee count
Email recency is reported on each country list linked below.
How this list was built
The recorded descriptions help you assess these company matches. Check a company’s website for its current services and locations.
- Source
- The RevenueBase company graph: 60 million companies and 398.9 million professional contacts resolved from primary sources, queried with RevenueBase SmartSearch, the natural-language company search available to every RevenueBase user.
- Coverage
- Every country. Country and city lists for computational drug discovery companies are linked below.
- What qualifies
- Company records worldwide whose business descriptions match “computational drug discovery companies” by meaning at the Exact setting. Descriptions are compiled in the RevenueBase company graph from public websites, profiles and company information where available; they are not guaranteed quotations from the company's website.
- RevenueBase SmartSearch
- Describe a niche company in your own words to find businesses by meaning. Exact, Similar, Related and Broad control the breadth of RevenueBase SmartSearch. This saved list uses Exact. Each row's Exact match badge shows inclusion in that search, not an individual score or a service-quality judgment.
- Public preview
- The public preview omits records without a verified work email. Dataset totals and geographic summaries describe the full matched records before these preview filters.
- Match quality
- RevenueBase's August 25, 2026 study assessed 4,198 description/company pairs across matching settings. The publisher reports 86% good or better at Exact. This evaluates the method across queries; it does not audit this individual list. Recorded company descriptions, where available, help you judge each match yourself. Read the full methodology: how the lists are built and what the study measures.
- Ranking
- Team size, largest first: companies are ordered by the number of professionals RevenueBase tracks at each one. Employee ranges shown are reported bands, for context.
- Verification
- Every displayed company carries at least one verified work email. RevenueBase tracks 14,864 professional contacts with verified work emails across the full matched dataset. Contacts re-verify on a rolling cadence, and each contact's own verification date is shown inside RevenueBase.
- Refresh
- This page's figures were pulled from the company graph on November 6, 2026. Lists refresh periodically as the graph is re-checked.
- Record context
- Company records and descriptions can change. Check the company's website for its current services and locations.
Computational drug discovery companies by location
14 lists · largest firstEvery Computational drug discovery companies list RevenueBase publishes, by country and city. Counts are matching companies in each list as of its own refresh date.
Countries
- Computational drug discovery companies based in the United States445
- Computational drug discovery companies based in the United Kingdom107
- Computational drug discovery companies based in India93
- Computational drug discovery companies based in Canada57
- Computational drug discovery companies based in France40
- Computational drug discovery companies based in Germany40
- Computational drug discovery companies based in Japan29
- Computational drug discovery companies based in South Korea26
Cities
- Computational drug discovery companies based in Boston, United States33
- Computational drug discovery companies based in San Francisco, United States33
- Computational drug discovery companies based in San Diego, United States32
- Computational drug discovery companies based in London, United Kingdom30
- Computational drug discovery companies based in Cambridge, United States28
- Computational drug discovery companies based in New York, United States26
Frequently asked
What is RevenueBase SmartSearch?
RevenueBase SmartSearch finds niche companies by the meaning of their business descriptions in the RevenueBase company graph. Exact, Similar, Related and Broad control how closely companies must fit your description. This list uses Exact for “computational drug discovery companies”; each Exact match badge shows search membership, not an individual similarity or quality score.
How many computational drug discovery companies are there worldwide?
RevenueBase identified 1,442 company matches for computational drug discovery companies worldwide as of November 2026, using the meaning of business descriptions at Exact. This is the recorded matched set in the RevenueBase company graph.
What is the largest company on this list?
Evotec tops the displayed preview by professional contacts tracked in RevenueBase. Recorded headquarters appear in the company rows.
Which country has the most computational drug discovery companies?
The United States leads with 445 companies, followed by the United Kingdom (107) and India (93). Every computational drug discovery companies list by country and city is linked on this page.
Which city has the most computational drug discovery companies?
Cambridge leads with 42 company records, followed by Boston (34) and San Francisco (33).
How do I get contact information for these companies?
A free RevenueBase account lets you run this exact search and work limited free results with 500 credits to start. Upgrading provides access to the 14,864 professional contacts with verified work emails tracked across these 1,442 companies; direct dials are available where recorded.
How current is this list?
The list refreshes periodically as the company graph is re-checked. This page's figures were pulled on November 6, 2026.
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About this data
RevenueBase is a B2B data infrastructure company. Its company graph covers 60 million companies and 398.9 million professional contacts, with emails verified on a rolling cadence rather than scraped once and left to decay. These company lists are generated directly from that graph with RevenueBase SmartSearch, the same natural-language company search every RevenueBase user has: describe a market in plain words, get the companies that match, and add verified emails and direct dials for the people at them. It is the same data that powers RevenueBase's B2B data products, and a free account includes 500 credits to start. How these lists are built and judged.
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Company intelligence · public preview
Top 25 computational drug discovery companies worldwide
Find companies in any niche.
Describe the businesses you want in your own words. RevenueBase SmartSearch matches company descriptions by meaning.
RevenueBase records 1,442 matching company records for computational drug discovery companies worldwide, with 35,304 tracked contacts and 14,864 verified work emails.
This public preview shows 25 selected records ordered by tracked contacts. RevenueBase SmartSearch finds company descriptions that match by meaning at Exact. Snapshot: November 6, 2026.
RevenueBase compiles business descriptions for niche-company discovery; each row shows a recorded excerpt where available. Adapt this search to find the companies and contacts you want.
Top 25 computational drug discovery companies worldwide
The public list shows selected company records with contact and verified-email coverage. Reported employee bands provide separate company-size context.
| # | Company | Headquarters on record | Reported employees | RevenueBase SmartSearch | Tracked contacts |
|---|---|---|---|---|---|
| 1 |  Evotecevotec.comHQ: Hamburg, GermanyReported employees: 5,001-10,000 | Hamburg, Germany | 5,001-10,000 | Exact match | 3,120 contacts → |
“Evotec is a biotechnology company that is committed to advancing drug discovery and development.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 2 |  Arisglobalarisglobal.comHQ: Waltham, United StatesReported employees: 1,001-5,000 | Waltham, United States | 1,001-5,000 | Exact match | 2,002 contacts → |
“ArisGlobal is an AI-first technology company at the forefront of life sciences and the creator of LifeSphere®, the platform trusted by hundreds of life sciences organizations…” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 3 |  Certaracertara.comHQ: Radnor, PA, United StatesReported employees: 1,001-5,000 | Radnor, PA, United States | 1,001-5,000 | Exact match | 1,214 contacts → |
“Certara accelerates medicines using proprietary biosimulation software, technology and services to transform traditional drug discovery and development.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 4 |  TCG Lifesciences PVT LTDtcgls.comHQ: Kolkata, IndiaReported employees: 1,001-5,000 | Kolkata, India | 1,001-5,000 | Exact match | 1,069 contacts → |
“TCG Lifesciences Pvt.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 5 |  Schrödingerschrodinger.comHQ: New York, NY, United StatesReported employees: 501-1,000 | New York, NY, United States | 501-1,000 | Exact match | 979 contacts → |
“Schrödinger’s industry-leading computational platform facilitates the research efforts of biopharmaceutical and industrial companies, academic institutions, and government…” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 6 |  Excelraexcelra.comHQ: Iselin, NJ, United StatesReported employees: 501-1,000 | Iselin, NJ, United States | 501-1,000 | Exact match | 943 contacts → |
“Discover how Excelra, a leader in biopharma data and analytics, uniquely blends scientific understanding with technological expertise.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 7 |  Aptuitaptuit.comHQ: Verona, ItalyReported employees: 501-1,000 | Verona, Italy | 501-1,000 | Exact match | 678 contacts → |
“Aptuit, an Evotec company, is a pharmaceutical services provider that offers the most complete set of integrated early discovery to mid-phase drug development solutions by…” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 8 |  O2h Discoveryo2hdiscovery.coHQ: Cambridge, United KingdomReported employees: 501-1,000 | Cambridge, United Kingdom | 501-1,000 | Exact match | 536 contacts → |
“Founded in 2005, o2h discovery is a Contract Research Organisation which has an integrated drug discovery platform operating from our state-of-the-art research centre in India and…” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 9 |  Isomorphic Labsisomorphiclabs.comHQ: London, United KingdomReported employees: 201-500 | London, United Kingdom | 201-500 | Exact match | 450 contacts → |
“Isomorphic Labs is here to advance human health by building on and beyond the Nobel-winning AlphaFold system.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 10 |  Precision Medicine Groupprecisionmedicinegrp.comHQ: Bethesda, MD, United StatesReported employees: 1,001-5,000 | Bethesda, MD, United States | 1,001-5,000 | Exact match | 439 contacts → |
“We founded Precision Medicine Group in 2012 because we believed there was a transformational opportunity to improve the process of bringing new drugs to market.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 11 |  Genedatagenedata.comHQ: Basel, SwitzerlandReported employees: 201-500 | Basel, Switzerland | 201-500 | Exact match | 417 contacts → |
“Genedata transforms biopharma data into intelligence.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 12 |  Envedaenveda.comHQ: Boulder, United StatesReported employees: 201-500 | Boulder, United States | 201-500 | Exact match | 379 contacts → |
“Enveda is a biotechnology company that is learning from life’s chemistry to create better medicines faster.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 13 |  Jubilant Chemsysjubilantbiosys.comHQ: Noida, IndiaReported employees: 501-1,000 | Noida, India | 501-1,000 | Exact match | 366 contacts → |
“Jubilant Chemsys Ltd (JCL); a company registered under the Indian Companies Act, 1956 offers services in synthetic, organic and medicinal chemistry areas to various pharmaceutical…” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 14 |  Novalixnovalix.comHQ: Strasbourg, FranceReported employees: 201-500 | Strasbourg, France | 201-500 | Exact match | 353 contacts → |
“Novalix is a premier drug discovery partner to biotech firms and pharmaceutical companies.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 15 |  Vernalisvernalis.comHQ: Cambridge, United KingdomReported employees: 51-200 | Cambridge, United Kingdom | 51-200 | Exact match | 346 contacts → |
“We develop and apply fragment and structure-based methods to solve problems in drug discovery, and have generated cell active lead compounds and development candidates against…” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 16 |  Insilico Medicineinsilico.comHQ: Boston, United StatesReported employees: 201-500 | Boston, United States | 201-500 | Exact match | 295 contacts → |
“Insilico Medicine, a clinical stage biotech company powered by generative AI, is connecting biology, chemistry, and clinical trials analysis using next-generation AI systems.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 17 |  Paraza Pharma INCparazapharma.comHQ: Montreal, QC, CanadaReported employees: 201-500 | Montreal, QC, Canada | 201-500 | Exact match | 259 contacts → |
No recorded description excerpt is available for this public record. | |||||
| 18 |  Xtalpi INCxtalpi.comHQ: Cambridge, MA, United StatesReported employees: 501-1,000 | Cambridge, MA, United States | 501-1,000 | Exact match | 257 contacts → |
“We are a quantum physics-based, AI-powered drug R&D company with the mission to revolutionize drug discovery and development by improving the speed, scale, novelty and success…” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 19 |  PI Health Sciences LTDpihealthsciences.comHQ: Hyderabad, IndiaReported employees: 501-1,000 | Hyderabad, India | 501-1,000 | Exact match | 220 contacts → |
“At PI Health Sciences, we provide fully integrated drug discovery solutions, combining synthetic and medicinal chemistry, biology, and AI-driven technologies.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 20 |  Xaira Therapeuticsxaira.comHQ: South San Francisco, United StatesReported employees: 51-200 | South San Francisco, United States | 51-200 | Exact match | 210 contacts → |
“Xaira Therapeutics is an integrated biotechnology company driving advances in artificial intelligence to learn the language of life and transform how we treat disease.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 21 |  Premas Biotechpremasbiotech.comHQ: Gurgaon, IndiaReported employees: 51-200 | Gurgaon, India | 51-200 | Exact match | 209 contacts → |
“Premas is developing transformational technologies and partnering with pharmaceutical companies around the world to expedite their drug discovery programs by cutting down…” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 22 |  Cyprotexcyprotex.comHQ: Macclesfield, United KingdomReported employees: 51-200 | Macclesfield, United Kingdom | 51-200 | Exact match | 208 contacts → |
“Founded in Cyprotex has grown to become an industry leader in in vitro and in silico ADME-Tox.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 23 |  Valo Healthvalohealth.comHQ: Lexington, NY, United StatesReported employees: 51-200 | Lexington, NY, United States | 51-200 | Exact match | 204 contacts → |
“Valo is a technology company built to transform drug discovery and development using large-scale data and AI-powered computation.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 24 |  Simulations Plus, INCsimulations-plus.comHQ: Durham, NC, United StatesReported employees: 201-500 | Durham, NC, United States | 201-500 | Exact match | 200 contacts → |
“Simulations Plus is a leading provider of modeling and simulation software and consulting services supporting drug discovery, development research, and regulatory submissions.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 25 |  Formation BIOformation.bioHQ: New York, NY, United StatesReported employees: 51-200 | New York, NY, United States | 51-200 | Exact match | 197 contacts → |
“Formation Bio is an AI-native pharma company differentiated by radically more efficient drug development.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
Showing 25 of 1,442 company matches
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Computational drug discovery companies: dataset insights
November 6, 2026These summaries describe recorded coverage in this saved dataset. This page is derived from saved source records; per-contact mobile coverage and email-recency results are not established by this snapshot.
Reported company sizes
1,437 records in the displayed employee bands.
5 matching records are outside the displayed bands or do not have a displayed size. Bars show shares of the displayed bands.
Email recency for this list is measured across the whole country list rather than for Worldwide, so it is reported there. Company counts and contact totals on this page are exact for Worldwide, over 1,442 companies.
How this company list was built
Describe a niche in your own words: companies installing commercial solar, or manufacturers of sustainable packaging. RevenueBase SmartSearch finds companies whose compiled business descriptions match by meaning. This list is one saved example to adapt.
Where the company descriptions come from
RevenueBase compiles company information from public sources, including company websites and public professional profiles such as LinkedIn, alongside information supplied by companies. The short recorded excerpt shown here is separate from the complete business description used for matching; individual source URLs and collection dates are not provided in this public snapshot.
RevenueBase SmartSearch matching settings
- Exact
- Closest fits to the business described.
- Similar
- Similar businesses with a wider range of fits.
- Related
- Related businesses in and around the category.
- Broad
- A broader set of businesses connected to the description.
RevenueBase SmartSearch · Exact match identifies inclusion in this search's closest semantic matching setting. It is not a per-company confidence score, a literal keyword match, or a quality endorsement.
Selection, ordering and scope
The public list shows selected company records with contact and verified-email coverage. Reported employee bands provide separate company-size context.
This page is derived from saved source records; per-contact mobile coverage and email-recency results are not established by this snapshot.
Recorded company descriptions support research; check company websites for current services. The selected preview is ordered by tracked contacts and is not a list of the best service providers.
Snapshot: November 6, 2026.
RevenueBase is a B2B data infrastructure company. Its September 3, 2026 published methodology describes a graph of 60 million companies and 398.9 million professional contacts; these platform figures differ from this page's totals. Published methodology ↗
Computational drug discovery companies by location
14 lists · largest firstEvery Computational drug discovery companies list RevenueBase publishes, by country and city. Counts are matching companies in each list as of its own refresh date.
Countries
- Computational drug discovery companies based in the United States445
- Computational drug discovery companies based in the United Kingdom107
- Computational drug discovery companies based in India93
- Computational drug discovery companies based in Canada57
- Computational drug discovery companies based in France40
- Computational drug discovery companies based in Germany40
- Computational drug discovery companies based in Japan29
- Computational drug discovery companies based in South Korea26
Cities
- Computational drug discovery companies based in Boston, United States33
- Computational drug discovery companies based in San Francisco, United States33
- Computational drug discovery companies based in San Diego, United States32
- Computational drug discovery companies based in London, United Kingdom30
- Computational drug discovery companies based in Cambridge, United States28
- Computational drug discovery companies based in New York, United States26
Questions about this company list
What does Exact match mean for computational drug discovery companies?
The separate RevenueBase SmartSearch column identifies inclusion at the closest semantic matching preset. It is not a literal keyword match, a per-company confidence score or a quality endorsement. Changing the search form opens a new search in RevenueBase; it does not reclassify these saved rows.
How many computational drug discovery companies did RevenueBase find worldwide?
The saved snapshot records 1,442 matching company records, 35,304 tracked contacts and 14,864 verified emails. The public preview displays 25 selected records.
Where do the company descriptions come from?
RevenueBase compiles company information from public sources, including company websites and public professional profiles such as LinkedIn, alongside information supplied by companies. The short recorded excerpt shown here is separate from the complete business description used for matching; individual source URLs and collection dates are not provided in this public snapshot.
How are the public companies ordered?
The selected public records are ordered by contacts tracked in RevenueBase, highest first. Contact coverage is a prospecting measure, not an assessment of the company's services or quality.
How can I get contact information?
Select a company's contact count to open its filtered contacts in RevenueBase. Free signup is required and includes 500 credits and limited free results. Verified emails, direct dials and mobile numbers depend on available coverage.
How current is this list?
Snapshot: November 6, 2026. Review each company's website for current services and locations. A recorded business description does not establish that every company offers every service named in the search.
What do headquarters and employee bands mean?
These are recorded company-level fields, rather than a map of every branch or a count of specialists. Missing headquarters or employee bands are labeled; older records may show a location separately from recorded headquarters.
Build your next target company list
Adapt this niche search and work with available contacts in RevenueBase.
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Cite this list
RevenueBase Data Team. Top 25 computational drug discovery companies worldwide. Snapshot: November 6, 2026. https://revenuebase.ai/companies/browse/computational-drug-discovery-companies.
This is a selected public preview of saved company records, rather than an independently verified census. Open the source page ↗
More company lists
Company intelligence · public preview
Top 25 computational drug discovery companies worldwide
RevenueBase records 1,442 matching company records for computational drug discovery companies worldwide, with 35,304 tracked contacts and 14,864 verified work emails.
This public preview shows 25 selected records ordered by tracked contacts. RevenueBase SmartSearch finds company descriptions that match by meaning at Exact. Snapshot: November 6, 2026.
RevenueBase compiles business descriptions for niche-company discovery; each row shows a recorded excerpt where available. Adapt this search to find the companies and contacts you want.
Top 25 computational drug discovery companies worldwide
The public list shows selected company records with contact and verified-email coverage. Reported employee bands provide separate company-size context.
| # | Company | Headquarters on record | Reported employees | RevenueBase SmartSearch | Tracked contacts |
|---|---|---|---|---|---|
| 1 | Evotecevotec.com HQ: Hamburg, GermanyReported employees: 5,001-10,000 | Hamburg, Germany | 5,001-10,000 | Exact match | 3,120 contacts → |
“Evotec is a biotechnology company that is committed to advancing drug discovery and development.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 2 | Arisglobalarisglobal.com HQ: Waltham, United StatesReported employees: 1,001-5,000 | Waltham, United States | 1,001-5,000 | Exact match | 2,002 contacts → |
“ArisGlobal is an AI-first technology company at the forefront of life sciences and the creator of LifeSphere®, the platform trusted by hundreds of life sciences organizations…” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 3 | Certaracertara.com HQ: Radnor, PA, United StatesReported employees: 1,001-5,000 | Radnor, PA, United States | 1,001-5,000 | Exact match | 1,214 contacts → |
“Certara accelerates medicines using proprietary biosimulation software, technology and services to transform traditional drug discovery and development.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 4 | TCG Lifesciences PVT LTDtcgls.com HQ: Kolkata, IndiaReported employees: 1,001-5,000 | Kolkata, India | 1,001-5,000 | Exact match | 1,069 contacts → |
“TCG Lifesciences Pvt.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 5 | Schrödingerschrodinger.com HQ: New York, NY, United StatesReported employees: 501-1,000 | New York, NY, United States | 501-1,000 | Exact match | 979 contacts → |
“Schrödinger’s industry-leading computational platform facilitates the research efforts of biopharmaceutical and industrial companies, academic institutions, and government…” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 6 | Excelraexcelra.com HQ: Iselin, NJ, United StatesReported employees: 501-1,000 | Iselin, NJ, United States | 501-1,000 | Exact match | 943 contacts → |
“Discover how Excelra, a leader in biopharma data and analytics, uniquely blends scientific understanding with technological expertise.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 7 | Aptuitaptuit.com HQ: Verona, ItalyReported employees: 501-1,000 | Verona, Italy | 501-1,000 | Exact match | 678 contacts → |
“Aptuit, an Evotec company, is a pharmaceutical services provider that offers the most complete set of integrated early discovery to mid-phase drug development solutions by…” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 8 | O2h Discoveryo2hdiscovery.co HQ: Cambridge, United KingdomReported employees: 501-1,000 | Cambridge, United Kingdom | 501-1,000 | Exact match | 536 contacts → |
“Founded in 2005, o2h discovery is a Contract Research Organisation which has an integrated drug discovery platform operating from our state-of-the-art research centre in India and…” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 9 | Isomorphic Labsisomorphiclabs.com HQ: London, United KingdomReported employees: 201-500 | London, United Kingdom | 201-500 | Exact match | 450 contacts → |
“Isomorphic Labs is here to advance human health by building on and beyond the Nobel-winning AlphaFold system.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 10 | Precision Medicine Groupprecisionmedicinegrp.com HQ: Bethesda, MD, United StatesReported employees: 1,001-5,000 | Bethesda, MD, United States | 1,001-5,000 | Exact match | 439 contacts → |
“We founded Precision Medicine Group in 2012 because we believed there was a transformational opportunity to improve the process of bringing new drugs to market.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 11 | Genedatagenedata.com HQ: Basel, SwitzerlandReported employees: 201-500 | Basel, Switzerland | 201-500 | Exact match | 417 contacts → |
“Genedata transforms biopharma data into intelligence.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 12 | Envedaenveda.com HQ: Boulder, United StatesReported employees: 201-500 | Boulder, United States | 201-500 | Exact match | 379 contacts → |
“Enveda is a biotechnology company that is learning from life’s chemistry to create better medicines faster.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 13 | Jubilant Chemsysjubilantbiosys.com HQ: Noida, IndiaReported employees: 501-1,000 | Noida, India | 501-1,000 | Exact match | 366 contacts → |
“Jubilant Chemsys Ltd (JCL); a company registered under the Indian Companies Act, 1956 offers services in synthetic, organic and medicinal chemistry areas to various pharmaceutical…” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 14 | Novalixnovalix.com HQ: Strasbourg, FranceReported employees: 201-500 | Strasbourg, France | 201-500 | Exact match | 353 contacts → |
“Novalix is a premier drug discovery partner to biotech firms and pharmaceutical companies.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 15 | Vernalisvernalis.com HQ: Cambridge, United KingdomReported employees: 51-200 | Cambridge, United Kingdom | 51-200 | Exact match | 346 contacts → |
“We develop and apply fragment and structure-based methods to solve problems in drug discovery, and have generated cell active lead compounds and development candidates against…” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 16 | Insilico Medicineinsilico.com HQ: Boston, United StatesReported employees: 201-500 | Boston, United States | 201-500 | Exact match | 295 contacts → |
“Insilico Medicine, a clinical stage biotech company powered by generative AI, is connecting biology, chemistry, and clinical trials analysis using next-generation AI systems.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 17 | Paraza Pharma INCparazapharma.com HQ: Montreal, QC, CanadaReported employees: 201-500 | Montreal, QC, Canada | 201-500 | Exact match | 259 contacts → |
No recorded description excerpt is available for this public record. | |||||
| 18 | Xtalpi INCxtalpi.com HQ: Cambridge, MA, United StatesReported employees: 501-1,000 | Cambridge, MA, United States | 501-1,000 | Exact match | 257 contacts → |
“We are a quantum physics-based, AI-powered drug R&D company with the mission to revolutionize drug discovery and development by improving the speed, scale, novelty and success…” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 19 | PI Health Sciences LTDpihealthsciences.com HQ: Hyderabad, IndiaReported employees: 501-1,000 | Hyderabad, India | 501-1,000 | Exact match | 220 contacts → |
“At PI Health Sciences, we provide fully integrated drug discovery solutions, combining synthetic and medicinal chemistry, biology, and AI-driven technologies.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 20 | Xaira Therapeuticsxaira.com HQ: South San Francisco, United StatesReported employees: 51-200 | South San Francisco, United States | 51-200 | Exact match | 210 contacts → |
“Xaira Therapeutics is an integrated biotechnology company driving advances in artificial intelligence to learn the language of life and transform how we treat disease.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 21 | Premas Biotechpremasbiotech.com HQ: Gurgaon, IndiaReported employees: 51-200 | Gurgaon, India | 51-200 | Exact match | 209 contacts → |
“Premas is developing transformational technologies and partnering with pharmaceutical companies around the world to expedite their drug discovery programs by cutting down…” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 22 | Cyprotexcyprotex.com HQ: Macclesfield, United KingdomReported employees: 51-200 | Macclesfield, United Kingdom | 51-200 | Exact match | 208 contacts → |
“Founded in Cyprotex has grown to become an industry leader in in vitro and in silico ADME-Tox.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 23 | Valo Healthvalohealth.com HQ: Lexington, NY, United StatesReported employees: 51-200 | Lexington, NY, United States | 51-200 | Exact match | 204 contacts → |
“Valo is a technology company built to transform drug discovery and development using large-scale data and AI-powered computation.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 24 | Simulations Plus, INCsimulations-plus.com HQ: Durham, NC, United StatesReported employees: 201-500 | Durham, NC, United States | 201-500 | Exact match | 200 contacts → |
“Simulations Plus is a leading provider of modeling and simulation software and consulting services supporting drug discovery, development research, and regulatory submissions.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
| 25 | Formation BIOformation.bio HQ: New York, NY, United StatesReported employees: 51-200 | New York, NY, United States | 51-200 | Exact match | 197 contacts → |
“Formation Bio is an AI-native pharma company differentiated by radically more efficient drug development.” Recorded description excerpt · November 6, 2026Open company data in RevenueBase ↗Free signup required. | |||||
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Computational drug discovery companies: dataset insights
November 6, 2026These summaries describe recorded coverage in this saved dataset. This page is derived from saved source records; per-contact mobile coverage and email-recency results are not established by this snapshot.
Reported company sizes
1,437 records in the displayed employee bands.
5 matching records are outside the displayed bands or do not have a displayed size. Bars show shares of the displayed bands.
Email recency for this list is measured across the whole country list rather than for Worldwide, so it is reported there. Company counts and contact totals on this page are exact for Worldwide, over 1,442 companies.
How this company list was built
Describe a niche in your own words: companies installing commercial solar, or manufacturers of sustainable packaging. RevenueBase SmartSearch finds companies whose compiled business descriptions match by meaning. This list is one saved example to adapt.
Where the company descriptions come from
RevenueBase compiles company information from public sources, including company websites and public professional profiles such as LinkedIn, alongside information supplied by companies. The short recorded excerpt shown here is separate from the complete business description used for matching; individual source URLs and collection dates are not provided in this public snapshot.
RevenueBase SmartSearch matching settings
- Exact
- Closest fits to the business described.
- Similar
- Similar businesses with a wider range of fits.
- Related
- Related businesses in and around the category.
- Broad
- A broader set of businesses connected to the description.
RevenueBase SmartSearch · Exact match identifies inclusion in this search's closest semantic matching setting. It is not a per-company confidence score, a literal keyword match, or a quality endorsement.
Selection, ordering and scope
The public list shows selected company records with contact and verified-email coverage. Reported employee bands provide separate company-size context.
This page is derived from saved source records; per-contact mobile coverage and email-recency results are not established by this snapshot.
Recorded company descriptions support research; check company websites for current services. The selected preview is ordered by tracked contacts and is not a list of the best service providers.
Snapshot: November 6, 2026.
RevenueBase is a B2B data infrastructure company. Its September 3, 2026 published methodology describes a graph of 60 million companies and 398.9 million professional contacts; these platform figures differ from this page's totals. Published methodology ↗
Computational drug discovery companies by location
14 lists · largest firstEvery Computational drug discovery companies list RevenueBase publishes, by country and city. Counts are matching companies in each list as of its own refresh date.
Countries
- Computational drug discovery companies based in the United States445
- Computational drug discovery companies based in the United Kingdom107
- Computational drug discovery companies based in India93
- Computational drug discovery companies based in Canada57
- Computational drug discovery companies based in France40
- Computational drug discovery companies based in Germany40
- Computational drug discovery companies based in Japan29
- Computational drug discovery companies based in South Korea26
Cities
- Computational drug discovery companies based in Boston, United States33
- Computational drug discovery companies based in San Francisco, United States33
- Computational drug discovery companies based in San Diego, United States32
- Computational drug discovery companies based in London, United Kingdom30
- Computational drug discovery companies based in Cambridge, United States28
- Computational drug discovery companies based in New York, United States26
Questions about this company list
What does Exact match mean for computational drug discovery companies?
The separate RevenueBase SmartSearch column identifies inclusion at the closest semantic matching preset. It is not a literal keyword match, a per-company confidence score or a quality endorsement. Changing the search form opens a new search in RevenueBase; it does not reclassify these saved rows.
How many computational drug discovery companies did RevenueBase find worldwide?
The saved snapshot records 1,442 matching company records, 35,304 tracked contacts and 14,864 verified emails. The public preview displays 25 selected records.
Where do the company descriptions come from?
RevenueBase compiles company information from public sources, including company websites and public professional profiles such as LinkedIn, alongside information supplied by companies. The short recorded excerpt shown here is separate from the complete business description used for matching; individual source URLs and collection dates are not provided in this public snapshot.
How are the public companies ordered?
The selected public records are ordered by contacts tracked in RevenueBase, highest first. Contact coverage is a prospecting measure, not an assessment of the company's services or quality.
How can I get contact information?
Select a company's contact count to open its filtered contacts in RevenueBase. Free signup is required and includes 500 credits and limited free results. Verified emails, direct dials and mobile numbers depend on available coverage.
How current is this list?
Snapshot: November 6, 2026. Review each company's website for current services and locations. A recorded business description does not establish that every company offers every service named in the search.
What do headquarters and employee bands mean?
These are recorded company-level fields, rather than a map of every branch or a count of specialists. Missing headquarters or employee bands are labeled; older records may show a location separately from recorded headquarters.
Build your next target company list
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Cite this list
RevenueBase Data Team. Top 25 computational drug discovery companies worldwide. Snapshot: November 6, 2026. https://revenuebase.ai/companies/browse/computational-drug-discovery-companies.
This is a selected public preview of saved company records, rather than an independently verified census. Open the source page ↗