Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | ACMSD | Q8TDX5 | 2/20 | 0.44 |
| ▸ | RARB | P10826 | 1/20 | 0.43 |
| ▸ | RARG | P13631 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.43 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MIF | P14174 | 1/20 | 0.43 |
| ▸ | TYR | P14679 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6874345 | 0.88 | CYP3A4 (0.42) | ATMACMSDCYP2C9ALDH1A1ALOX15 | |
| SCHEMBL156312 | 0.87 | ACMSD (0.53) | ATMACMSDCYP2C9ALDH1A1ALOX15 | |
| SCHEMBL21630427 | 0.87 | ACMSD (0.53) | ATMACMSDCYP2C9ALDH1A1ALOX15 | |
| SCHEMBL3009268 | 0.85 | ACMSD (0.51) | ATMACMSDCYP2C9ALDH1A1ALOX15 | |
| SCHEMBL19677868 | 0.84 | CA2 (0.55) | ACMSDCYP2C9ALDH1A1ALOX15TYR | |
| SCHEMBL23861380 | 0.84 | CYP3A4 (0.43) | ACMSDCYP2C9CYP3A4HSP90AA1MAPT | |
| SCHEMBL8633611 | 0.83 | HSD17B1 (0.47) | ACMSDCYP2C9CYP3A4HSP90AA1MAPT | |
| SCHEMBL19677858 | 0.81 | CA2 (0.55) | CYP2C9ALDH1A1TYRCYP3A4ESR1 | |
| SCHEMBL1176397 | 0.78 | ALDH1A1 (0.67) | RARBRARGCYP2C9ALDH1A1ALOX15 | |
| SCHEMBL31146788 | 0.78 | ALDH1A1 (0.67) | RARBRARGCYP2C9ALDH1A1ALOX15 |
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-5723500-A | WATER INSOLUBLE, NONCATIONIC, ANTIBACTERIAL, STERICALLY HINDERED PHENOL; MOUTHWASHES, DENTIFRICES | COLGATE-PALMOLIVE COMPANY (US) | 1998-03-03 | — | — | US | disclosed |