Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | CDK1 | P06493 | 1/20 | 0.36 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.36 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.36 |
| ▸ | BTK | Q06187 | 1/20 | 0.35 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.33 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 6/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22785799 | 0.70 | CHEK1 (0.44) | HSD17B10GAACDK1CDK2LRRK2 | |
| SCHEMBL2956640 | 0.65 | NOS3 (0.39) | HSD17B10NPC1RAB9ACYP1A2TP53 | |
| SCHEMBL16081490 | 0.64 | PDE1A (0.34) | HSD17B10NPC1RAB9ACYP1A2TP53 | |
| SCHEMBL11750751 | 0.64 | CDC7 (0.42) | HSD17B10NPC1RAB9ACYP1A2TP53 | |
| SCHEMBL23571576 | 0.64 | GRM5 (0.38) | HSD17B10NPC1RAB9ACDK1CCNB1 | |
| SCHEMBL6341576 | 0.64 | KDM4E (0.42) | HSD17B10NPC1RAB9ACYP1A2TP53 | |
| SCHEMBL11703860 | 0.62 | MCHR1 (0.50) | CYP1A2TP53GAACYP2C9CYP2C19 | |
| SCHEMBL1592856 | 0.61 | BTK (0.37) | HSD17B10NPC1RAB9ACYP1A2TP53 | |
| SCHEMBL14928306 | 0.61 | KDM4E (0.40) | HSD17B10NPC1RAB9ATP53GAA | |
| SCHEMBL30844856 | 0.61 | CDK1 (0.41) | HSD17B10NPC1RAB9ACYP1A2TP53 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2651516-B1 | DYE COMPOSITION COMPRISING A HETEROCYCLIC OXIDATION BASE AND A 4-AMINOINDOLE COUPLER | L'ORÉAL (FR) | 2017-06-14 | — | — | EP | disclosed |