Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 5/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.46 |
| ▸ | AR | P10275 | 1/20 | 0.46 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | PKM | P14618 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | G6PD | P11413 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL525507 | 0.83 | ALDH1A1 (0.48) | ESR1ESR2ARPDE10AALDH1A1 | |
| SCHEMBL29752049 | 0.83 | CYP3A4 (0.60) | ESR1ESR2ARPDE10AALDH1A1 | |
| SCHEMBL456953 | 0.83 | CYP3A4 (0.60) | ESR1ESR2ARPDE10AALDH1A1 | |
| Hydrochloric Acid SCHEMBL5204358 | 0.81 | ALDH1A1 (0.46) | ESR1ESR2ARPDE10AALDH1A1 | |
| SCHEMBL10481218 | 0.81 | CYP3A4 (0.63) | ALDH1A1CYP3A4ALOX15HSD17B10MAPK1 | |
| 2,4-Diaminophenol SCHEMBL5870897 | 0.77 | PDE10A (0.61) | ESR1ESR2ARPDE10AALDH1A1 | |
| SCHEMBL10256689 | 0.74 | CYP3A4 (0.60) | ESR1ESR2ARPDE10AALDH1A1 | |
| SCHEMBL29673743 | 0.74 | CYP3A4 (0.60) | ESR1ESR2ARPDE10AALDH1A1 | |
| SCHEMBL5963088 | 0.71 | CYP3A4 (0.55) | ESR1ESR2ARPDE10AALDH1A1 | |
| SCHEMBL3077884 | 0.71 | ALDH1A1 (0.50) | ESR1ESR2ARPDE10AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0416962-B1 | KERATINOUS FIBERS DYEING PROCESS WITH INDOLE DYES AND OXIDATION DYE PRECURSORS AND DYEING AGENTS | L'OREAL (FR) | 1993-09-22 | — | — | EP | claimed |