Company lists · Data refreshed November 2026

Top 25 Structure-based drug design companies worldwide

RevenueBase identified 913 company matches for structure-based drug design companies worldwide as of November 2026 and tracks 19,946 professional contacts across them, including 8,661 with verified work emails. The United States is the largest market and San Diego the largest hub.

This list covers company matches for structure-based drug design 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 structure-based drug design 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 Nov 6, 2026 How this list was built
913Companies
19,946Contacts tracked
8,661Verified emails
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The 25 largest structure-based drug design companies worldwide

Ranked by team size
Top 25 of 913 company matches for structure-based drug design companies worldwide, ordered by professional contacts tracked in RevenueBase, largest first. Recorded Nov 6, 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 matchRadnor, PA, United StatesHQ recorded Nov 6, 20261,001-5,0001,214 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
2Exact matchNew York, NY, United StatesHQ recorded Nov 6, 2026501-1,000979 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
3Exact matchVerona, ItalyHQ recorded Nov 6, 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 · Nov 6, 2026 · View company records in RevenueBase
4Exact matchCambridge, United KingdomHQ recorded Nov 6, 2026501-1,000536 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
5Exact matchLondon, United KingdomHQ recorded Nov 6, 2026201-500450 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
6Exact matchNoida, IndiaHQ recorded Nov 6, 2026501-1,000366 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
7Exact matchCambridge, United KingdomHQ recorded Nov 6, 202651-200346 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
8Exact matchHyderabad, IndiaHQ recorded Nov 6, 2026501-1,000317 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 · Nov 6, 2026 · View company records in RevenueBase
9Exact matchCambridge, MA, United StatesHQ recorded Nov 6, 202651-200298 contacts →

Exact match

“Nuvalent is creating precisely targeted therapies for patients with cancer designed to overcome the limitations of existing therapies for clinically proven kinase targets.”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
10Exact matchSan Diego, CA, United StatesHQ recorded Nov 6, 2026201-500286 contacts →

Exact match

Recorded description not available.

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
11Exact matchMontreal, QC, CanadaHQ recorded Nov 6, 2026201-500259 contacts →

Exact match

Recorded description not available.

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
12Exact matchTokyo, JapanHQ recorded Nov 6, 2026201-500259 contacts →

Exact match

“Nxera Pharma is a technology powered biopharma company in pursuit of new specialty medicines to improve the lives of patients with unmet needs in Japan and globally.”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
13Exact matchCambridge, MA, United StatesHQ recorded Nov 6, 202651-200253 contacts →

Exact match

“Relay Therapeutics is a clinical-stage precision medicines company transforming the drug discovery process.”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
14Exact matchCinisello Balsamo, ItalyHQ recorded Nov 6, 2026201-500230 contacts →

Exact match

“Italian Company part of the ITALFARMACO Group, specialized in the development of non-infringing processes, full characterization of complex molecules, with competence to support…”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
15Exact matchHyderabad, IndiaHQ recorded Nov 6, 2026501-1,000220 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
16Exact matchDurham, NC, United StatesHQ recorded Nov 6, 2026201-500200 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
17Exact matchVancouver, WA, United StatesHQ recorded Nov 6, 202651-200190 contacts →

Exact match

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

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
18Exact matchGlasgow, United KingdomHQ recorded Nov 6, 202651-200181 contacts →

Exact match

“Accelerating molecular discovery through the power of Chemputation.”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
19Exact matchBudapest, HungaryHQ recorded Nov 6, 2026201-500181 contacts →

Exact match

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

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
20Exact matchNew York, NY, United StatesHQ recorded Nov 6, 202651-200173 contacts →

Exact match

“D.”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
21Exact matchWaltham, United StatesHQ recorded Nov 6, 2026201-500164 contacts →

Exact match

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

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
22Exact matchPlanegg-martinsried, GermanyHQ recorded Nov 6, 202651-200160 contacts →

Exact match

“Proteros is an early drug discovery partner for even the most technically challenging targets, from target through to lead progression.”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
23Exact matchCambridge, United KingdomHQ recorded Nov 6, 202651-200146 contacts →

Exact match

“Astex Pharmaceuticals is a world leader in innovative drug discovery.”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
24Exact matchPasadena, CA, United StatesHQ recorded Nov 6, 202651-200144 contacts →

Exact match

“Terray is a biotechnology company with the technology, data, and mindset to radically change the way we discover and develop small molecule therapeutics.”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase
25Exact matchNanjing, ChinaHQ recorded Nov 6, 20261,001-5,000134 contacts →

Exact match

“PharmaBlock was officially operated in 2008 as a provider of drug-like small molecule building blocks and has since evolved into a fully integrated CRDMO partner following its IPO…”

Recorded in the RevenueBase company graph · Nov 6, 2026 · View company records in RevenueBase

Showing 25 of 913 structure-based drug design companies worldwide

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Structure-based drug design companies worldwide at a glance

As of Nov 6, 2026
43.4%Verified-email coverage
21.8Average contacts per company
1-10Median size (employees)
2.8%Largest-city concentration · San Diego
Nov 6, 2026Page data refreshed

Companies by employee count

1-10
487
11-50
293
51-200
91
201-500
24
501-1,000
8
1,001-5,000
5
10001+
1

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 structure-based drug design companies are linked below.
What qualifies
Company records worldwide whose business descriptions match “structure-based drug design 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 8,661 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.

Structure-based drug design companies by location

7 lists · largest first

Every Structure-based drug design companies list RevenueBase publishes, by country and city. Counts are matching companies in each list as of its own refresh date.

Countries

Cities

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 “structure-based drug design companies”; each Exact match badge shows search membership, not an individual similarity or quality score.

How many structure-based drug design companies are there worldwide?

RevenueBase identified 913 company matches for structure-based drug design 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?

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

Which country has the most structure-based drug design companies?

The United States leads with 283 companies, followed by the United Kingdom (64) and India (58). Every structure-based drug design companies list by country and city is linked on this page.

Which city has the most structure-based drug design companies?

San Diego leads with 26 company records, followed by Cambridge (24) and San Francisco (19).

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 8,661 professional contacts with verified work emails tracked across these 913 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.