Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.46 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | CASP1 | P29466 | 3/20 | 0.38 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | TTR | P02766 | 1/20 | 0.36 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.35 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.35 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.35 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6811930 | 0.77 | CYP3A4 (0.51) | CYP3A4CA1CA2TSHRCASP1 | |
| SCHEMBL29793551 | 0.72 | CYP3A4 (0.52) | CYP3A4CA1CA2TSHRCASP1 | |
| SCHEMBL2284135 | 0.72 | CYP3A4 (0.52) | CYP3A4CA1CA2TSHRCASP1 | |
| SCHEMBL1154282 | 0.71 | ALDH1A1 (0.36) | CYP3A4CA1CA2TSHRCASP1 | |
| SCHEMBL22453194 | 0.70 | FSCN1 (0.46) | CYP3A4TSHRALDH1A1HPGDALOX15 | |
| Hydrochloric Acid SCHEMBL9788679 | 0.70 | GAA (0.53) | CYP3A4CA1CA2TSHRCASP1 | |
| Hydrochloric Acid SCHEMBL9788683 | 0.70 | GAA (0.53) | CYP3A4CA1CA2TSHRCASP1 | |
| SCHEMBL21186206 | 0.68 | CYP3A4 (0.39) | CYP3A4TSHRCYP2C9CYP2C19MAPK13 | |
| SCHEMBL11508894 | 0.68 | ALDH1A1 (0.57) | CYP3A4CA1CA2TSHRCASP1 | |
| SCHEMBL736511 | 0.67 | FSCN1 (0.69) | CYP3A4CA1CA2TSHRCASP1 |
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-4233241-A | LEUCO INDOANILINE DYES FOR HAIR | L'OREAL (FR) | 1980-11-11 | — | — | US | disclosed |
| US-4008043-A | Diphenylamines for dyeing keratinic fibers | L'OREAL (FR) | 1977-02-15 | — | — | US | disclosed |