Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | AURKA | O14965 | 2/20 | 0.35 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.35 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | CASP7 | P55210 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | PDE4A | P27815 | 1/20 | 0.31 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7812193 | 0.78 | GAA (0.44) | CYP3A4TSHRMAPK1ALDH1A1AURKA | |
| SCHEMBL15416944 | 0.76 | CDK2 (0.47) | TSHRCDK2ALDH1A1AURKAADORA2A | |
| SCHEMBL7808739 | 0.75 | ALDH1A1 (0.34) | CDK2ALDH1A1 | |
| SCHEMBL7808698 | 0.75 | ALDH1A1 (0.36) | CDK2ALDH1A1 | |
| SCHEMBL18755070 | 0.74 | ALDH1A1 (0.43) | CYP3A4TSHRMAPK1CDK2ALDH1A1 | |
| SCHEMBL31167504 | 0.74 | GPR35 (0.44) | CDK2ALDH1A1AURKAAURKBINCENP | |
| SCHEMBL6865280 | 0.73 | AURKA (0.38) | CYP3A4TSHRMAPK1CDK2ALDH1A1 | |
| SCHEMBL7800798 | 0.73 | PDPK1 (0.39) | CYP3A4TSHRMAPK1CDK2ALDH1A1 | |
| SCHEMBL7805963 | 0.73 | CDK2 (0.38) | CYP3A4TSHRCDK2ALDH1A1AURKA | |
| Hydrochloric Acid SCHEMBL8099675 | 0.72 | PDPK1 (0.38) | CYP3A4TSHRMAPK1CDK2ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0943614-B1 | Dyeing agents comprising diaminobenzene derivatives and the diaminobenzene derivatives | WELLA AG (DE) | 2001-12-12 | — | — | EP | disclosed |
| US-6042620-A | FOR DYEING KERATIN FIBERS SUCH AS HAIR | WELLA AG (DE) | 2000-03-28 | — | — | US | disclosed |
| EP-0943614-A2 | Dyeing agents comprising diaminobenzene derivatives and the diaminobenzene derivatives | Wella Aktiengesellschaft (DE) | 1999-09-22 | — | — | EP | disclosed |