Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | CDK1 | P06493 | 1/20 | 0.45 |
| ▸ | CDK2 | P24941 | 1/20 | 0.45 |
| ▸ | WDR91 | A4D1P6 | 3/20 | 0.44 |
| ▸ | ME3 | Q16798 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | NOTUM | Q6P988 | 3/20 | 0.41 |
| ▸ | ABL1 | P00519 | 1/20 | 0.41 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.41 |
| ▸ | RORC | P51449 | 3/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4536703 | 0.89 | TDP1 (0.44) | ARTDP1CDK2ME3KDM4E | |
| SCHEMBL2958737 | 0.88 | TDP1 (0.53) | TDP1CDK1CDK2ME3KDM4E | |
| SCHEMBL1750887 | 0.82 | AR (0.49) | ARCDK1CDK2WDR91ALDH1A1 | |
| SCHEMBL1750888 | 0.82 | AR (0.49) | ARCDK1CDK2WDR91ALDH1A1 | |
| SCHEMBL6365465 | 0.82 | AR (0.49) | ARCDK1CDK2WDR91NOTUM | |
| SCHEMBL16695637 | 0.82 | NOTUM (0.60) | ARCDK1CDK2WDR91ALDH1A1 | |
| SCHEMBL9106437 | 0.82 | NOTUM (0.60) | ARCDK1CDK2WDR91ALDH1A1 | |
| SCHEMBL15570454 | 0.82 | AR (0.49) | ARCDK1CDK2WDR91ALDH1A1 | |
| SCHEMBL853367 | 0.82 | AR (0.49) | ARTDP1CDK1CDK2WDR91 | |
| SCHEMBL33623 | 0.82 | AR (0.49) | ARTDP1CDK1CDK2WDR91 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0853079-B1 | Production of keto acids | CIBA SC HOLDING AG (CH) | 2002-06-05 | — | — | EP | claimed |
| US-5925787-A | Production of keto acids | CIBA SPECIALTY CHEMICALS CORPORATION (US) | 1999-07-20 | — | — | US | claimed |
| EP-0853079-A1 | Production of keto acids | Ciba SC Holding AG (CH) | 1998-07-15 | — | — | EP | claimed |
| EP-0133578-B1 | 3-ARYL-3-PYRROLINE DERIVATIVES, PROCESS FOR THEIR PREPARATION, AND MEDICAMENTS CONTAINING THEM FOR THE TREATMENT OF HEART AND VASCULAR DISEASES | GÖDECKE AKTIENGESELLSCHAFT (DE) | 1990-08-01 | — | — | EP | disclosed |
| US-4626546-A | ANTIISCHEMIC, HYPERTENSIVE AGENTS | WARNER-LAMBERT COMPANY (US) | 1986-12-02 | — | — | US | disclosed |
| EP-0133578-A2 | 3-Aryl-3-pyrroline derivatives, process for their preparation, and medicaments containing them for the treatment of heart and vascular diseases | GÖDECKE AKTIENGESELLSCHAFT (DE) | 1985-02-27 | — | — | EP | disclosed |