Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 6/20 | 0.71 |
| ▸ | TSHR | P16473 | 2/20 | 0.71 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.62 |
| ▸ | CA3 | P07451 | 3/20 | 0.62 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.62 |
| ▸ | CASP1 | P29466 | 2/20 | 0.62 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.62 |
| ▸ | THRB | P10828 | 1/20 | 0.62 |
| ▸ | CA6 | P23280 | 1/20 | 0.62 |
| ▸ | APP | P05067 | 4/20 | 0.48 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
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 | |
|---|---|---|---|---|
| 4-Aminophenol SCHEMBL2107012 | 1.00 | ALOX15 (0.71) | ALOX15TSHRHSD17B10CYP3A4CA3 | |
| Questiomycin B SCHEMBL6047097 | 0.93 | ALOX15 (0.83) | ALOX15TSHRHSD17B10CYP3A4CA3 | |
| 4-Aminophenol SCHEMBL27725228 | 0.90 | ALOX15 (0.58) | ALOX15TSHRHSD17B10CYP3A4CA3 | |
| 4-Aminophenol SCHEMBL27531500 | 0.88 | ALOX15 (0.56) | ALOX15TSHRHSD17B10CYP3A4CA3 | |
| 4-Aminophenol SCHEMBL27531499 | 0.88 | ALOX15 (0.56) | ALOX15TSHRHSD17B10CYP3A4CA3 | |
| 4-Aminophenol SCHEMBL27308492 | 0.87 | ALDH1A1 (0.61) | ALOX15TSHRHSD17B10CYP3A4CA3 | |
| Questiomycin B SCHEMBL3319943 | 0.85 | ALOX15 (0.79) | ALOX15TSHRHSD17B10CYP3A4CA3 | |
| Questiomycin B SCHEMBL22169180 | 0.85 | ALOX15 (0.79) | ALOX15TSHRHSD17B10CYP3A4CA3 | |
| Questiomycin B SCHEMBL27470396 | 0.85 | ALOX15 (0.79) | ALOX15TSHRHSD17B10CYP3A4CA3 | |
| Questiomycin B SCHEMBL3999786 | 0.84 | ALOX15 (1.00) | ALOX15TSHRHSD17B10CYP3A4CA3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0865269-A4 | SYNTHESIS OF QUATERNARY MELANIN COMPOUNDS AND THEIR USE AS HAIR DYES OR FOR SKIN TREATMENT | BRISTOL MYERS SQUIBB CO (US) | 2000-01-19 | — | — | EP | disclosed |
| EP-0865269-A1 | SYNTHESIS OF QUATERNARY MELANIN COMPOUNDS AND THEIR USE AS HAIR DYES OR FOR SKIN TREATMENT | Bristol-Myers Squibb Company (US) | 1998-09-23 | — | — | EP | disclosed |
| WO-1997020542-A1 | SYNTHESIS OF QUATERNARY MELANIN COMPOUNDS AND THEIR USE AS HAIR DYES OR FOR SKIN TREATMENT | BRISTOL-MYERS SQUIBB COMPANY (US) | 1997-06-12 | — | — | WO | disclosed |