Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | AURKA | O14965 | 2/20 | 0.32 |
| ▸ | KDR | P35968 | 1/20 | 0.32 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.32 |
| ▸ | CDK2 | P24941 | 1/20 | 0.31 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.31 |
| ▸ | RET | P07949 | 1/20 | 0.31 |
| ▸ | FLT3 | P36888 | 1/20 | 0.31 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.31 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7805963 | 0.79 | CDK2 (0.38) | CYP3A4ALDH1A1TSHRADORA2AAURKA | |
| SCHEMBL26892991 | 0.78 | AURKA (0.40) | ALDH1A1TSHRADORA2AAURKAKDR | |
| SCHEMBL7807385 | 0.74 | KMT2A (0.39) | MEN1KMT2ACDK2 | |
| SCHEMBL7812193 | 0.73 | GAA (0.44) | CYP3A4ALDH1A1TSHRADORA2AMEN1 | |
| SCHEMBL20370293 | 0.72 | AURKA (0.39) | ADORA2AAURKAKDRCDK2AURKB | |
| SCHEMBL7800798 | 0.72 | PDPK1 (0.39) | CYP3A4ALDH1A1TSHRADORA2AMEN1 | |
| Hydrochloric Acid SCHEMBL8099675 | 0.70 | PDPK1 (0.38) | CYP3A4ALDH1A1TSHRTHRBADORA2A | |
| SCHEMBL5174258 | 0.69 | ALDH1A1 (0.52) | CYP3A4ALDH1A1TSHRTHRBMEN1 | |
| SCHEMBL2466401 | 0.69 | IDO1 (0.56) | CYP3A4ALDH1A1TSHRMEN1KMT2A | |
| SCHEMBL6137058 | 0.69 | KDM1A (0.47) | CYP3A4ALDH1A1TSHRTHRBMEN1 |
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 |