Company lists · Data refreshed September 2026

Top 25 Drug discovery simulation companies worldwide

RevenueBase identified 1,294 company matches for drug discovery simulation companies worldwide as of September 2026 and tracks 26,539 professional contacts across them, including 10,448 with verified work emails. The United States is the largest market and Cambridge the largest hub.

This list covers company matches for drug discovery simulation 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 September 19, 2026. Country and city lists for drug discovery simulation 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.

How to read this list RevenueBase SmartSearch · Exact Recorded Sep 19, 2026 How this list was built
1,294Companies
26,539Contacts tracked
10,448Verified emails
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The 25 largest drug discovery simulation companies worldwide

Ranked by team size
Top 25 of 1,294 company matches for drug discovery simulation companies worldwide, ordered by professional contacts tracked in RevenueBase, largest first. Recorded Sep 19, 2026. The RevenueBase SmartSearch column shows Exact match membership in this saved search. Click a contact count to view that company's people. Totals use company locations recorded by RevenueBase; the displayed preview is a smaller selection.
#CompanyRevenueBase SmartSearchHeadquartersEmployeesContacts
1Exact matchWaltham, MA, United StatesHQ recorded Sep 19, 20261,001-5,0001,905 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 · Sep 19, 2026 · View company records in RevenueBase
2Exact matchRadnor, PA, United StatesHQ recorded Sep 19, 20261,001-5,0001,237 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 · Sep 19, 2026 · View company records in RevenueBase
3Exact matchNew York, NY, United StatesHQ recorded Sep 19, 2026501-1,000957 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 · Sep 19, 2026 · View company records in RevenueBase
4Exact matchVerona, ItalyHQ recorded Sep 19, 2026501-1,000678 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 · Sep 19, 2026 · View company records in RevenueBase
5Exact matchCambridge, United KingdomHQ recorded Sep 19, 2026501-1,000521 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 · Sep 19, 2026 · View company records in RevenueBase
6Exact matchNoida, IndiaHQ recorded Sep 19, 2026501-1,000353 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 · Sep 19, 2026 · View company records in RevenueBase
7Exact matchStrasbourg, FranceHQ recorded Sep 19, 2026201-500347 contacts →

Exact match

“Novalix is a premier drug discovery partner to biotech firms and pharmaceutical companies.”

Recorded in the RevenueBase company graph · Sep 19, 2026 · View company records in RevenueBase
8Exact matchLondon, MA, United KingdomHQ recorded Sep 19, 2026201-500333 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 · Sep 19, 2026 · View company records in RevenueBase
9Exact matchCambridge, United KingdomHQ recorded Sep 19, 202651-200330 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 · Sep 19, 2026 · View company records in RevenueBase
10Exact matchHyderabad, IndiaHQ recorded Sep 19, 2026501-1,000311 contacts →

Exact match

“LAXAI Life Sciences is a leading small molecule CRDMO providing end-to-end Integrated Drug Discovery, Development, and Manufacturing solutions to the pharmaceutical and biotech…”

Recorded in the RevenueBase company graph · Sep 19, 2026 · View company records in RevenueBase
11Exact matchBoston, MA, United StatesHQ recorded Sep 19, 2026201-500281 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 · Sep 19, 2026 · View company records in RevenueBase
12Exact matchMontreal, QC, CanadaHQ recorded Sep 19, 2026201-500266 contacts →

Exact match

Recorded description not available.

Recorded in the RevenueBase company graph · Sep 19, 2026 · View company records in RevenueBase
13Exact matchKraków, PolandHQ recorded Sep 19, 202651-200235 contacts →

Exact match

“Ryvu Therapeutics is a clinical-stage drug discovery and development company focused on novel small molecule therapies that address emerging targets in oncology.”

Recorded in the RevenueBase company graph · Sep 19, 2026 · View company records in RevenueBase
14Exact matchCambridge, MA, United StatesHQ recorded Sep 19, 2026501-1,000224 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 · Sep 19, 2026 · View company records in RevenueBase
15Exact matchHyderabad, IndiaHQ recorded Sep 19, 2026501-1,000196 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 · Sep 19, 2026 · View company records in RevenueBase
16Exact matchGurgaon, IndiaHQ recorded Sep 19, 202651-200195 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 · Sep 19, 2026 · View company records in RevenueBase
17Exact matchMacclesfield, United KingdomHQ recorded Sep 19, 202651-200192 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 · Sep 19, 2026 · View company records in RevenueBase
18Exact matchLexington, MA, United StatesHQ recorded Sep 19, 202651-200191 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 · Sep 19, 2026 · View company records in RevenueBase
19Exact matchToronto, ON, CanadaHQ recorded Sep 19, 2026201-500184 contacts →

Exact match

“Advanced Chemistry Development, Inc,(ACD/Labs) develops and commercialzes informatics solutions for chemical, biochemical, and pharmaceutical R&D.”

Recorded in the RevenueBase company graph · Sep 19, 2026 · View company records in RevenueBase
20Exact matchBudapest, HungaryHQ recorded Sep 19, 2026201-500183 contacts →

Exact match

“Chemaxon is a leading cheminformatics company, setting the industry standard for quality and accuracy.”

Recorded in the RevenueBase company graph · Sep 19, 2026 · View company records in RevenueBase
21Exact matchDurham, NC, United StatesHQ recorded Sep 19, 2026201-500182 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 · Sep 19, 2026 · View company records in RevenueBase
22Exact matchSouth San Francisco, CA, United StatesHQ recorded Sep 19, 202651-200179 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 · Sep 19, 2026 · View company records in RevenueBase
23Exact matchVancouver, WA, United StatesHQ recorded Sep 19, 202651-200174 contacts →

Exact match

“Absci is a data-first AI drug creation company designing differentiated therapeutics using generative AI.”

Recorded in the RevenueBase company graph · Sep 19, 2026 · View company records in RevenueBase
24Exact matchRiga, LatviaHQ recorded Sep 19, 2026201-500164 contacts →

Exact match

“Latvian Institute of Organic Synthesis (LIOS) is a public research institute which possesses a broad spectrum of drug discovery and development process expertise including…”

Recorded in the RevenueBase company graph · Sep 19, 2026 · View company records in RevenueBase
25Exact matchWaltham, MA, United StatesHQ recorded Sep 19, 2026201-500156 contacts →

Exact match

“X-Chem is your preferred partner for innovative small molecule discovery.”

Recorded in the RevenueBase company graph · Sep 19, 2026 · View company records in RevenueBase

Showing 25 of 1,294 drug discovery simulation companies worldwide

See the full list, filter by size, metro and specialty, and access 10,448 tracked professional contacts with verified work emails. Direct dials are available where recorded.

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Drug discovery simulation companies worldwide at a glance

As of Sep 19, 2026
39.4%Verified-email coverage
20.5Average contacts per company
1-10Median size (employees)
2.9%Largest-city concentration · Cambridge
Sep 19, 2026Page data refreshed

Companies by employee count

1-10
716
11-50
417
51-200
110
201-500
24
501-1,000
15
1,001-5,000
6
5,001-10,000
1
10001+
2

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 drug discovery simulation companies are linked below.
What qualifies
Company records worldwide whose business descriptions match “drug discovery simulation 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 10,448 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 September 19, 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.

Drug discovery simulation companies by location

7 lists · largest first

Every Drug discovery simulation companies list RevenueBase publishes, by country and city. Counts are matching companies in each list as of its own refresh date.

Countries

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 “drug discovery simulation companies”; each Exact match badge shows search membership, not an individual similarity or quality score.

How many drug discovery simulation companies are there worldwide?

RevenueBase identified 1,294 company matches for drug discovery simulation companies worldwide as of September 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?

Arisglobal tops the displayed preview by professional contacts tracked in RevenueBase. Recorded headquarters appear in the company rows.

Which country has the most drug discovery simulation companies?

The United States leads with 412 companies, followed by the United Kingdom (100) and India (81). Every drug discovery simulation companies list by country and city is linked on this page.

Which city has the most drug discovery simulation companies?

Cambridge leads with 37 company records, followed by London (33) and San Diego (32).

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 10,448 professional contacts with verified work emails tracked across these 1,294 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 September 19, 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.