Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.64 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.64 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.46 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.46 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.41 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7392714 | 0.93 | ALDH1A1 (0.61) | ALDH1A1MAPK1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL7388114 | 0.91 | ALDH1A1 (0.58) | ALDH1A1MAPK1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL7013428 | 0.91 | ALDH1A1 (0.58) | ALDH1A1MAPK1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL7393481 | 0.91 | ALDH1A1 (0.58) | ALDH1A1MAPK1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL9671249 | 0.87 | SLC2A1 (0.47) | ALDH1A1MAPK1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL1780869 | 0.85 | ALDH1A1 (0.70) | ALDH1A1MAPK1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL420011 | 0.85 | ALDH1A1 (0.78) | ALDH1A1MAPK1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL1931125 | 0.85 | ALDH1A1 (0.78) | ALDH1A1MAPK1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL10389986 | 0.82 | ALDH1A1 (0.48) | ALDH1A1MAPK1CYP1A2CYP2D6CYP2C19 | |
| SCHEMBL10390215 | 0.82 | ALDH1A1 (0.48) | ALDH1A1MAPK1CYP1A2CYP2D6CYP2C19 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008096128-A1 | OXAZOLE AND THIAZOLE DERIVATIVES AND THEIR USES 2 | ARGENTA DISCOVERY LTD (GB) | 2008-08-14 | — | — | WO | disclosed |
| WO-2008096128-A1 | OXAZOLE AND THIAZOLE DERIVATIVES AND THEIR USES 2 | ARGENTA DISCOVERY LTD (GB) | 2008-08-14 | — | — | WO | disclosed |
| EP-0658555-B1 | Pyridazinone derivatives, processes for production thereof and use thereof | NIHON NOHYAKU CO LTD (JP) | 1997-11-12 | — | — | EP | disclosed |
| US-5604226-A | CEREBRAL INFARCTION OR MYOCARDIAL INFARCTION | NIHON NOHYAKU CO., LTD. (JP) | 1997-02-18 | — | — | US | disclosed |
| US-5510375-A | VIRICIDES TREATING INFECTION CAUSED BY HUMAN IMMUNODEFICIENCY VIRUS AND AIDS | WARNER-LAMBERT COMPANY (US) | 1996-04-23 | — | — | US | disclosed |
| EP-0658555-A1 | Pyridazinone derivatives, processes for production thereof and use thereof | NIHON NOHYAKU CO., LTD. (JP) | 1995-06-21 | — | — | EP | disclosed |
| US-5135940-A | Antiallegens, antiinflammatory agents | MERCK FROSST CANADA, INC. (CA) | 1992-08-04 | — | — | US | disclosed |
| US-4906658-A | Fluoro-sulfones | MERCK FROSST CANADA, INC. (CA) | 1990-03-06 | — | — | US | disclosed |
| US-4876248-A | Anti-inflammatory products derived from methylene-diphosphonic acid, and process for their preparation | SANOFI (FR) | 1989-10-24 | — | — | US | disclosed |
| US-4857659-A | Stereoselective synthesis of leukotriene antagonists | MERCK FROSST CANADA, INC. (CA) | 1989-08-15 | — | — | US | disclosed |
| EP-0252639-A1 | Leukotriene antagonists | MERCK FROSST CANADA INC. (CA) | 1988-01-13 | — | — | EP | disclosed |
| EP-0244164-A1 | Stereoselective synthesis of leukotriene antagonists | MERCK FROSST CANADA INC. (CA) | 1987-11-04 | — | — | EP | disclosed |
| US-4621098-A | Thioethers and pharmaceutical compositions containing them | BOEHRINGER MANNHEIM GMBH (DE) | 1986-11-04 | — | — | US | disclosed |
| EP-0104885-B1 | LEUKOTRIENE ANTAGONISTS, THEIR PRODUCTION, AND COMPOSITIONS CONTAINING THEM | MERCK FROSST CANADA INC. (CA) | 1986-06-04 | — | — | EP | disclosed |
| EP-0156233-A2 | Use of leukotriene antagonists for producing cytoprotective pharmaceutical compositions and process for producing cytoprotective pharmaceutical compositions | MERCK & CO. INC. (US) | 1985-10-02 | — | — | EP | disclosed |
| EP-0035228-B1 | TETRAZOLE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF, AND ANTI-ULCER COMPOSITION CONTAINING THE SAME | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1985-01-02 | — | — | EP | disclosed |
| EP-0104885-A1 | Leukotriene antagonists, their production, and compositions containing them | MERCK FROSST CANADA INC. (CA) | 1984-04-04 | — | — | EP | disclosed |
| US-4372953-A | Tetrazole derivatives, and anti-ulcer composition containing the same | OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) | 1983-02-08 | — | — | US | disclosed |
| EP-0035228-A1 | Tetrazole derivatives, process for the preparation thereof, and anti-ulcer composition containing the same | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1981-09-09 | — | — | EP | disclosed |
| US-4246201-A | Substituted N-(3-phenylthiopropyl)-3,3-diphenyl-propylamines possessing pharmacological activity | ALFA FARMACEUTICI, S.P.A. (IT) | 1981-01-20 | — | — | US | disclosed |