Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC7 | O00311 | 1/20 | 0.35 |
| ▸ | IKBKB | O14920 | 1/20 | 0.35 |
| ▸ | AURKA | O14965 | 1/20 | 0.35 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.35 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.35 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.35 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.35 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.35 |
| ▸ | CDK1 | P06493 | 1/20 | 0.35 |
| ▸ | FES | P07332 | 1/20 | 0.35 |
| ▸ | RET | P07949 | 1/20 | 0.35 |
| ▸ | IGF1R | P08069 | 1/20 | 0.35 |
| ▸ | ROS1 | P08922 | 1/20 | 0.35 |
| ▸ | PIM1 | P11309 | 1/20 | 0.35 |
| ▸ | PHKG2 | P15735 | 1/20 | 0.35 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | AXL | P30530 | 1/20 | 0.35 |
| ▸ | MATK | P42679 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9344302 | 0.73 | CYP2A6 (0.44) | CYP1A2CYP2A6AHRTP53TSHR | |
| SCHEMBL29508990 | 0.73 | CYP2A6 (0.44) | CYP1A2CYP2A6AHRTP53TSHR | |
| SCHEMBL9310672 | 0.73 | CYP1A2 (0.48) | AURKADAPK3PRKD3MAP4K4RET | |
| SCHEMBL11428765 | 0.67 | S100A4 (0.44) | CYP1A2TYMSCES1TSHRLMNA | |
| SCHEMBL8927927 | 0.65 | UCHL1 (0.33) | TSHRALDH1A1 | |
| SCHEMBL15517767 | 0.62 | CYP2A6 (0.42) | CYP1A2CYP2A6TYMSAHRTP53 | |
| SCHEMBL29962329 | 0.62 | TSHR (0.39) | CYP1A2CYP2A6AHRTP53TSHR | |
| SCHEMBL9512355 | 0.62 | TSHR (0.39) | CYP1A2CYP2A6AHRTP53TSHR | |
| SCHEMBL1477149 | 0.62 | CES1 (0.50) | CYP1A2CYP2A6CES1TP53TSHR | |
| SCHEMBL8927819 | 0.60 | AHR (0.41) | CYP1A2CES1AHRTP53TSHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2006107595-A1 | REDUCTIVE COLORANT FOR KERATIN FIBRES | THE PROCTER & GAMBLE COMPANY (US) | 2006-10-12 | — | — | WO | disclosed |