Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SKP2 | Q13309 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | SRC | P12931 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | CNR1 | P21554 | 1/20 | 0.30 |
| ▸ | CNR2 | P34972 | 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 | |
|---|---|---|---|---|
| SCHEMBL27495210 | 0.81 | SKP2 (0.52) | SKP2NPC1RAB9ATSHRSMN1; SMN2 | |
| SCHEMBL20917425 | 0.79 | HTT (0.43) | NPC1RAB9ATP53TSHRSMN1; SMN2 | |
| SCHEMBL1498868 | 0.78 | SKP2 (0.57) | SKP2NPC1RAB9ATP53SMN1; SMN2 | |
| SCHEMBL9359662 | 0.77 | SKP2 (0.53) | SKP2NPC1RAB9ATSHRSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL6657545 | 0.76 | SKP2 (0.55) | SKP2NPC1RAB9ASMN1; SMN2NOS2 | |
| SCHEMBL10383766 | 0.76 | SKP2 (0.47) | SKP2NPC1RAB9ATP53TSHR | |
| SCHEMBL28621111 | 0.75 | SKP2 (0.46) | SKP2RAB9ATP53TSHRSMN1; SMN2 | |
| SCHEMBL5503406 | 0.74 | SKP2 (0.37) | SKP2NPC1RAB9ATP53TSHR | |
| SCHEMBL11342257 | 0.74 | SKP2 (0.50) | SKP2NPC1RAB9ATSHRSMN1; SMN2 | |
| SCHEMBL24088998 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4261926-A | REACTION WITH KETONE IN PRESENCE OF PLATINUM HYDROGENATION CATALYST AND A PROMOTER ACID | AMERICAN CYANAMID COMPANY (US) | 1981-04-14 | — | — | US | disclosed |