Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.63 |
| ▸ | RAB9A | P51151 | 3/20 | 0.63 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.63 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.63 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.63 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.63 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.63 |
| ▸ | KDR | P35968 | 1/20 | 0.55 |
| ▸ | KCNMA1 | Q12791 | 2/20 | 0.54 |
| ▸ | TP53 | P04637 | 2/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.53 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.53 |
| ▸ | MDM4 | O15151 | 1/20 | 0.53 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | APEX1 | P27695 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL26885288 | 0.82 | HDAC2 (0.50) | NPC1RAB9ACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL4946074 | 0.82 | NPC1 (0.73) | NPC1RAB9ACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL1470784 | 0.82 | NPC1 (0.73) | NPC1RAB9ACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL10948587 | 0.82 | APEX1 (0.52) | NPC1RAB9ACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL10480100 | 0.81 | NPC1 (0.72) | NPC1RAB9ACYP2D6CYP2C9KDR | |
| SCHEMBL11688577 | 0.80 | NPC1 (0.56) | NPC1RAB9ATP53MAPK1POLB | |
| SCHEMBL13619183 | 0.79 | APEX1 (0.81) | NPC1RAB9ACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL5723835 | 0.78 | POLB (0.64) | NPC1RAB9ACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL10904451 | 0.78 | APEX1 (0.79) | NPC1RAB9ACYP1A2CYP3A4CYP2D6 | |
| SCHEMBL26885284 | 0.78 | KCNMA1 (0.46) | NPC1RAB9AKCNMA1TP53HDAC1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5372917-A | Excellent color forming property, storage stability and recorded image preservability; pyrazolone derivatives | KANZAKI PAPER MANUFACTURING CO., LTD. (JP) | 1994-12-13 | — | — | US | disclosed |
| US-4703111-A | Water-soluble compounds containing one or two (nitrophenylamino)-phenylamino-chlorotriazinylamino groups, the nitrophenylamino being additionally substituted by a fiber-reactive group of the vinylsulfonyl series, suitable as dyestuffs | HOECHST AKTIENGESELLSCHAFT A CORP. OF GERMANY (DE) | 1987-10-27 | — | — | US | disclosed |
| US-4677199-A | Reactive dyes containing substituted 4-fluoropyridaz-6-one radicals | BASF AKTIENGESELLSCHAFT (DE) | 1987-06-30 | — | — | US | disclosed |
| US-4354968-A | Azo reactive dyestuffs having an aryl-triazinyl-aryl diazo component | BAYER AKTIENGESELLSCHAFT (DE) | 1982-10-19 | — | — | US | disclosed |
| US-3966704-A | Naphthylazo naphthyl copper complex dyestuffs | HOECHST AKTIENGESELLSCHAFT (DT) | 1976-06-29 | — | — | US | disclosed |