Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.48 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | HTT | P42858 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | HTR3A | P46098 | 1/20 | 0.47 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | GPR3 | P46089 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | NQO2 | P16083 | 1/20 | 0.44 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28571 | 0.98 | PDE10A (0.52) | PDE10ACYP1A2NPC1ALDH1A1HPGD | |
| Hydrochloric Acid SCHEMBL29004253 | 0.95 | PDE10A (0.50) | PDE10ACYP1A2NPC1ALDH1A1HPGD | |
| SCHEMBL30961661 | 0.95 | PDE10A (0.50) | PDE10ACYP1A2NPC1ALDH1A1HPGD | |
| Water SCHEMBL16742371 | 0.95 | PDE10A (0.50) | PDE10ACYP1A2NPC1ALDH1A1HPGD | |
| Formaldehyde SCHEMBL28095446 | 0.91 | ALDH1A1 (0.47) | PDE10ACYP1A2NPC1ALDH1A1HPGD | |
| SCHEMBL28560110 | 0.87 | CYP1A2 (0.47) | PDE10ACYP1A2NPC1ALDH1A1HPGD | |
| SCHEMBL28242358 | 0.87 | NCF1 (0.48) | PDE10ACYP1A2NPC1ALDH1A1HPGD | |
| Acetaldehyde SCHEMBL11425484 | 0.87 | ALDH1A1 (0.44) | PDE10ACYP1A2NPC1ALDH1A1HPGD | |
| SCHEMBL19508472 | 0.85 | NQO2 (0.56) | PDE10ACYP1A2NPC1ALDH1A1RAB9A | |
| SCHEMBL8174637 | 0.84 | ALDH1A1 (0.46) | PDE10ACYP1A2NPC1ALDH1A1HPGD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4228151-A | QUINOXALINE DIOXIDE | L'OREAL (FR) | 1980-10-14 | — | — | US | claimed |
| US-4228151-A | QUINOXALINE DIOXIDE | L'OREAL (FR) | 1980-10-14 | — | — | US | disclosed |