Company lists · Data refreshed September 2026

Top 25 Drug discovery software companies based in the United Kingdom

RevenueBase identified 145 drug discovery software companies headquartered in the United Kingdom as of September 2026 and tracks 5,200 professional contacts across them, including 2,006 with verified work emails and 631 with mobile numbers. London is the largest hub.

This list covers drug discovery software companies headquartered in the United Kingdom, matched on what each company actually does as described in its own words. Ranked by team size, largest first. Every row shows the company's own description, its RevenueBase Smart Search rating, and when it was last checked. Data refreshed September 1, 2026.

Published by RevenueBase, a B2B data infrastructure company. This list was built with RevenueBase Smart Search, 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 Smart Search rating on every row Refreshed Sep 1, 2026 86% judged on-target in blind review
145Companies
5,200Contacts tracked
2,006Verified emails
631Mobile numbers
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The 25 largest drug discovery software companies based in the United Kingdom

Ranked by team size
Top 25 of 145 drug discovery software companies based in the United Kingdom, ranked by team size, largest first. Data refreshed Sep 1, 2026. RevenueBase Smart Search rates how each company's information relates to drug discovery software companies: strong evidence (its own description names it), partial (names part of it), indirect (matched on the rest of its profile rather than the description shown). Click a contact count to view that company's people.
#CompanyRevenueBase Smart SearchHeadquartersEmployeesContacts
1Strong evidenceAbingdon, United Kingdom501-1,000680 contacts →

Strong evidence

“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…”

Source: RevenueBase Database · checked Sep 1, 2026
2Strong evidenceGreat Abington Cambridge, United Kingdom51-200330 contacts →

Strong evidence

“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…”

Source: RevenueBase Database · checked Sep 1, 2026
3Indirect evidenceLondon, United Kingdom201-500324 contacts →

Indirect evidence

“Isomorphic Labs is here to advance human health by building on and beyond the Nobel-winning AlphaFold system.”

Source: RevenueBase Database · checked Sep 1, 2026
4Indirect evidenceWoking, United Kingdom201-500282 contacts →

Indirect evidence

“IDBS helps BioPharma organizations unlock the potential of AI/ML to improve the lives of patients.”

Source: RevenueBase Database · checked Sep 1, 2026
5Indirect evidenceGreat Abington, United Kingdom201-500257 contacts →

Indirect evidence

“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.”

Source: RevenueBase Database · checked Sep 1, 2026
6Indirect evidenceBracknell, United Kingdom201-500185 contacts →

Indirect evidence

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

Source: RevenueBase Database · checked Sep 1, 2026
7Partial evidenceGlasgow, United Kingdom51-200148 contacts →

Partial evidence

“Accelerating molecular discovery through the power of Chemputation.”

Source: RevenueBase Database · checked Sep 1, 2026
8Strong evidenceCambridge, United Kingdom51-200138 contacts →

Strong evidence

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

Source: RevenueBase Database · checked Sep 1, 2026
9Partial evidenceLondon, United Kingdom51-200135 contacts →

Partial evidence

“Our mission at Causaly is to redefine the boundaries of human discovery by harnessing transformative AI technologies.”

Source: RevenueBase Database · checked Sep 1, 2026
10Partial evidenceCambridge, United Kingdom51-20097 contacts →

Partial evidence

“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…”

Source: RevenueBase Database · checked Sep 1, 2026
11Strong evidenceLittle Chesterford Saffron Walden, United Kingdom51-20094 contacts →

Strong evidence

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

Source: RevenueBase Database · checked Sep 1, 2026
12Indirect evidenceOxford, United Kingdom501-1,00093 contacts →

Indirect evidence

“Exscientia is now Recursion.”

Source: RevenueBase Database · checked Sep 1, 2026
13Strong evidenceNewhouse, United Kingdom51-20086 contacts →

Strong evidence

“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.”

Source: RevenueBase Database · checked Sep 1, 2026
14Partial evidenceOxford, United Kingdom11-5066 contacts →

Partial evidence

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

Source: RevenueBase Database · checked Sep 1, 2026
15Partial evidenceForest Row, United Kingdom51-20064 contacts →

Partial evidence

“Pion supports drug development programs with in vitro scientific instruments, contract research, and equipment maintenance.”

Source: RevenueBase Database · checked Sep 1, 2026
16Strong evidenceCambridge, United Kingdom51-20063 contacts →

Strong evidence

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

Source: RevenueBase Database · checked Sep 1, 2026
17Strong evidenceLondon, United Kingdom51-20062 contacts →

Strong evidence

“LabGenius Therapeutics ("LabGenius") is a drug discovery company pioneering the discovery of next-generation therapeutic antibodies.”

Source: RevenueBase Database · checked Sep 1, 2026
18Indirect evidenceDundee, United Kingdom1,001-5,00062 contacts →

Indirect evidence

“We are Malvern Panalytical.”

Source: RevenueBase Database · checked Sep 1, 2026
19Strong evidenceCambridge, United Kingdom51-20057 contacts →

Strong evidence

“Healx is a mission-driven technology company pioneering the next generation of drug discovery in order to bring novel, effective treatments to rare disease patients around the…”

Source: RevenueBase Database · checked Sep 1, 2026
20Partial evidenceCambridge, United Kingdom51-20053 contacts →

Partial evidence

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

Source: RevenueBase Database · checked Sep 1, 2026
21Indirect evidenceOxford, United Kingdom11-5050 contacts →

Indirect evidence

“Nucleome was founded in 2019.”

Source: RevenueBase Database · checked Sep 1, 2026
22Indirect evidenceAbingdon, United Kingdom11-5044 contacts →

Indirect evidence

“Arctoris is a tech-enabled Partnership Research Organization (PRO) headquartered in Oxford.”

Source: RevenueBase Database · checked Sep 1, 2026
23Strong evidenceLondon, United Kingdom51-20043 contacts →

Strong evidence

“Receptor.AI is a TechBio drug discovery company that combines a multi-platform AI ecosystem with a modality-agnostic decision engine to define the right therapeutic strategy and…”

Source: RevenueBase Database · checked Sep 1, 2026
24Partial evidenceSouthampton, United Kingdom11-5040 contacts →

Partial evidence

“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.”

Source: RevenueBase Database · checked Sep 1, 2026
25Strong evidenceUnited Kingdom11-5037 contacts →

Strong evidence

“PhoreMost is a new-model drug discovery company based in Cambridge, UK.”

Source: RevenueBase Database · checked Sep 1, 2026

Showing 25 of 145 drug discovery software companies based in the United Kingdom

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

As of Sep 1, 2026
38.6%Verified-email coverage
12.1%Mobile-number coverage
35.9Average contacts per company
11-50Median size (employees)
29.0%Largest-city concentration · London
Sep 1, 2026Page data refreshed

Companies by employee count

1-10
70
11-50
41
51-200
22
201-500
5
501-1,000
2
1,001-5,000
2

How this list was built

Company categories are rarely black and white. RevenueBase reads each company's own description of its business to decide whether it belongs among drug discovery software companies, so some rows will be adjacent to the category rather than pure plays. The description and RevenueBase Smart Search rating on every row are there so you can check each match yourself.

Source
The RevenueBase company graph: 60 million companies and 398.9 million professional contacts resolved from primary sources, queried with RevenueBase Smart Search, the natural-language company search available to every RevenueBase user.
What qualifies
Companies headquartered in the United Kingdom whose own description of what they do matches “drug discovery software companies”. Matching reads each company's description, not its industry code or its name.
RevenueBase Smart Search
RevenueBase Smart Search is how this list is assembled and how each row is rated. RevenueBase's data engine and AI assess a company's LinkedIn profile, information supplied directly by the company, its website and other publicly available information, then relate it to a category defined in a user's own words. Each row is rated strong evidence (its own description names drug discovery software companies), partial evidence (it names part of the category) or indirect evidence (the description shown names none of it and the match rests on the rest of the company's profile). The description supporting each rating is quoted on the row.
What we exclude
Companies whose own description does not clearly place them among drug discovery software companies, and records with no verified work email. Companies headquartered outside United Kingdom are excluded even when they keep an office there.
Match quality
In blind human judging of this matching method, 86% of matched companies were on target. Expect roughly 1 in 7 rows to be adjacent to the category rather than a pure play. Every row shows the company's own description and its RevenueBase Smart Search rating so you can judge each match yourself. Read the full methodology: how the lists are built, how the judging worked, and what the figure means.
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 listed company carries at least one verified work email, 2,006 across the full list. 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.
Corrections
Wrong category, wrong headquarters, or a company that has closed? Use “Report an issue” on any row. Reports go to the RevenueBase Data Team and feed back into the company graph.

Drug discovery software companies by metro

Frequently asked

What is RevenueBase Smart Search?

RevenueBase Smart Search is how RevenueBase decides which companies belong on this list and how strongly each one fits. Its data engine and AI assess a company's LinkedIn profile, information supplied directly by the company, its website and other publicly available information, then relate it to the category the list is about. Each row is rated strong evidence when the company's own description names drug discovery software companies, partial evidence when it names part of the category, and indirect evidence when the description shown names none of it and the match rests on the rest of the company's profile.

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

RevenueBase identified 145 drug discovery software companies headquartered in the United Kingdom as of September 2026, matched on each company's own description of what it does rather than its industry code.

What is the largest company on this list?

Aptuit, headquartered in Abingdon, tops this list with the largest team on record.

Which city has the most drug discovery software companies?

London leads with 42 headquartered companies, followed by Cambridge (19) and Oxford (9).

How do I get contact information for these companies?

A free RevenueBase account lets you run this exact search and work the top results, verified emails and direct dials included. Upgrading unlocks all 2,006 verified decision-maker contacts tracked across these 145 companies.

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.

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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 Smart Search, 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.