Company lists · Data refreshed September 2026

Top 25 Drug design software companies based in the United Kingdom

RevenueBase identified 80 company matches for drug design software companies associated with the United Kingdom as of September 2026 and tracks 2,560 professional contacts across them, including 1,214 with verified work emails and 243 with mobile numbers. London is the largest hub.

This list covers company matches for drug design software companies associated with the United Kingdom, 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 1, 2026.

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 1, 2026 How this list was built
80Companies
2,560Contacts tracked
1,214Verified emails
243Mobile numbers
Explore this list → Free signup · no credit card · 500 free credits

The 25 largest drug design software companies based in the United Kingdom

Ranked by team size
Top 25 of 80 company matches for drug design software companies based in the United Kingdom, ordered by professional contacts tracked in RevenueBase, largest first. Recorded Sep 1, 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 matchAbingdon, United Kingdom501-1,000680 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 1, 2026 · View company records in RevenueBase
2Exact matchGreat Abington Cambridge, United Kingdom51-200330 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 1, 2026 · View company records in RevenueBase
3Exact matchLondon, United Kingdom201-500324 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 1, 2026 · View company records in RevenueBase
4Exact matchBracknell, United Kingdom201-500185 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 1, 2026 · View company records in RevenueBase
5Exact matchGlasgow, United Kingdom51-200148 contacts →

Exact match

“Accelerating molecular discovery through the power of Chemputation.”

Recorded in the RevenueBase company graph · Sep 1, 2026 · View company records in RevenueBase
6Exact matchCambridge, United Kingdom51-20097 contacts →

Exact match

“Cresset® is revolutionizing molecule design and cross-team communication, combining cutting-edge science with AI/ML to enable our customers to discover new compounds faster and…”

Recorded in the RevenueBase company graph · Sep 1, 2026 · View company records in RevenueBase
7Exact matchLittle Chesterford Saffron Walden, United Kingdom51-20094 contacts →

Exact match

“Domainex is a fully integrated drug discovery service company based near Cambridge, UK serving pharmaceutical, biotechnology, academic and patient foundations globally.”

Recorded in the RevenueBase company graph · Sep 1, 2026 · View company records in RevenueBase
8Exact matchNewhouse, United Kingdom51-20086 contacts →

Exact match

“Founded in 2013, BioAscent is a leading provider of integrated drug discovery services based at the former Organon / MSD R&D site in Newhouse, Scotland, UK.”

Recorded in the RevenueBase company graph · Sep 1, 2026 · View company records in RevenueBase
9Exact matchOxford, United Kingdom11-5066 contacts →

Exact match

“OMass Therapeutics is a private pharmaceutical company, focused on structural mass spectrometry to discover novel medicines.”

Recorded in the RevenueBase company graph · Sep 1, 2026 · View company records in RevenueBase
10Exact matchCambridge, United Kingdom51-20063 contacts →

Exact match

“RxCelerate Limited provides drug discovery and development services across Europe and the USA.”

Recorded in the RevenueBase company graph · Sep 1, 2026 · View company records in RevenueBase
11Exact matchCambridge, United Kingdom51-20053 contacts →

Exact match

“Optibrium provides elegant software solutions for small molecule design, optimisation and data analysis.”

Recorded in the RevenueBase company graph · Sep 1, 2026 · View company records in RevenueBase
12Exact matchSouthampton, United Kingdom11-5040 contacts →

Exact match

“Our mission is to transform the discovery of first-in-class small molecule therapeutics by broadening the landscape of disease targets that can be drugged.”

Recorded in the RevenueBase company graph · Sep 1, 2026 · View company records in RevenueBase
13Exact matchLondon, United Kingdom11-5035 contacts →

Exact match

“Peptone is a therapeutics company that uses AI and an experimental physics product engine to design small molecules targeting the 6,200 intrinsically disordered human proteins…”

Recorded in the RevenueBase company graph · Sep 1, 2026 · View company records in RevenueBase
14Exact matchManchester, United Kingdom11-5034 contacts →

Exact match

“C4XD is a pioneering Drug Discovery company, combining scientific expertise with cutting-edge technologies to efficiently deliver world‑leading medicines.”

Recorded in the RevenueBase company graph · Sep 1, 2026 · View company records in RevenueBase
15Exact matchCambridge, United Kingdom51-20031 contacts →

Exact match

“Standigm is a workflow AI-driven drug discovery company.”

Recorded in the RevenueBase company graph · Sep 1, 2026 · View company records in RevenueBase
16Exact matchChesham, United Kingdom11-5022 contacts →

Exact match

“Leading bio/pharma's resource efficiency evaluation software.”

Recorded in the RevenueBase company graph · Sep 1, 2026 · View company records in RevenueBase
17Exact matchLondon, United Kingdom11-5020 contacts →

Exact match

“PolyModels Hub is a biotech software company building the digital backbone for biopharma process development.”

Recorded in the RevenueBase company graph · Sep 1, 2026 · View company records in RevenueBase
18Exact matchLondon, United Kingdom11-5016 contacts →

Exact match

“PentaBind is a VC-backed drug discovery company using Artificial Intelligence and an integrated wet-laboratory to design high performance aptamers with multiple drug-like…”

Recorded in the RevenueBase company graph · Sep 1, 2026 · View company records in RevenueBase
19Exact matchLondon, United Kingdom1-1014 contacts →

Exact match

“Modern drug design software for chemists”

Recorded in the RevenueBase company graph · Sep 1, 2026 · View company records in RevenueBase
20Exact matchChapel-En-Le-Frith, United Kingdom51-20013 contacts →

Exact match

“Peakdale Molecular is now Concept Life Sciences.”

Recorded in the RevenueBase company graph · Sep 1, 2026 · View company records in RevenueBase
21Exact matchLondon, United Kingdom1-1011 contacts →

Exact match

“Kuano is applying advanced computational methods to solve the hardest problems in therapeutic design, accelerating the path to life-changing medicines.”

Recorded in the RevenueBase company graph · Sep 1, 2026 · View company records in RevenueBase
22Exact matchLondon, United Kingdom1-108 contacts →

Exact match

“Oppilotech have developed a high-resolution platform based on systems biology and machine learning to model biological processes in cells.”

Recorded in the RevenueBase company graph · Sep 1, 2026 · View company records in RevenueBase
23Exact matchSandwich, United Kingdom1-106 contacts →

Exact match

“When you’re dealing with millions of chemicals with thousands of new ones added each day, working out which are regulated or controlled can be difficult.”

Recorded in the RevenueBase company graph · Sep 1, 2026 · View company records in RevenueBase
24Exact matchLondon, United Kingdom1-106 contacts →

Exact match

“Axiom Therapeutics is a techbio company founded on the vision of harnessing quantum-accurate physics and machine learning to design covalent medicines that maximise clinical…”

Recorded in the RevenueBase company graph · Sep 1, 2026 · View company records in RevenueBase
25Exact matchBorehamwood, United Kingdom11-505 contacts →

Exact match

“Molecular Discovery was established in 1984 to provide the GRID software to scientists working on the field of Drug Design.”

Recorded in the RevenueBase company graph · Sep 1, 2026 · View company records in RevenueBase

Showing 25 of 80 drug design software companies based in the United Kingdom

See the full list, filter by size, metro and specialty, and access 1,214 tracked professional contacts with verified work emails. Direct dials are available where recorded.

Free signup · no credit card

View the full list →

Drug design software companies based in the United Kingdom at a glance

As of Sep 1, 2026
47.4%Verified-email coverage
9.5%Mobile-number coverage
32.0Average contacts per company
1-10Median size (employees)
32.5%Largest-city concentration · London
Sep 1, 2026Page data refreshed

Companies by employee count

1-10
45
11-50
19
51-200
11
201-500
2
501-1,000
1

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.
What qualifies
Company records associated with the United Kingdom whose business descriptions match “drug design software 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. Where headquarters information is recorded, preview rows are also filtered to this page’s location. 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 1,214 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 1, 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.

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 design software companies”; each Exact match badge shows search membership, not an individual similarity or quality score.

How many drug design software companies are there based in the United Kingdom?

RevenueBase identified 80 company matches for drug design software companies associated with the United Kingdom 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?

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

Which city has the most drug design software companies?

London leads with 26 company records, followed by Cambridge (9) and Oxford (3).

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 1,214 professional contacts with verified work emails tracked across these 80 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 1, 2026.

Ready to reach these companies? Verified emails and direct dials for all 80 drug design software companies based in the United Kingdom. Start with a free account, no credit card.

Download this list →

Related lists

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.