Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.61 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.61 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.59 |
| ▸ | MEN1 | O00255 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.59 |
| ▸ | CFTR | P13569 | 2/20 | 0.58 |
| ▸ | AR | P10275 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.50 |
| ▸ | ITGB3 | P05106 | 7/20 | 0.49 |
| ▸ | ITGA2B | P08514 | 7/20 | 0.49 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.49 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.49 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.49 |
| ▸ | CSNK2A3 | Q8NEV1 | 1/20 | 0.49 |
| ▸ | KMO | O15229 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL3749301 | 0.88 | ALDH1A1 (0.67) | CYP3A4CYP2D6CYP2C9SCN9AALDH1A1 | |
| SCHEMBL13078605 | 0.86 | ALDH1A1 (0.59) | CYP3A4CYP2D6CYP2C9SCN9AALDH1A1 | |
| SCHEMBL7316490 | 0.86 | ALDH1A1 (0.53) | CYP3A4CYP2D6CYP2C9SCN9AALDH1A1 | |
| SCHEMBL7426086 | 0.84 | ALDH1A1 (0.51) | CYP3A4CYP2D6CYP2C9SCN9AALDH1A1 | |
| SCHEMBL1196689 | 0.84 | KDM4E (0.73) | CYP3A4CYP2D6CYP2C9SCN9AALDH1A1 | |
| SCHEMBL13044095 | 0.83 | ALDH1A1 (0.56) | CYP3A4CYP2D6CYP2C9SCN9AALDH1A1 | |
| SCHEMBL5999161 | 0.83 | LTA4H (0.54) | CYP3A4CYP2D6CYP2C9SCN9AALDH1A1 | |
| SCHEMBL7436637 | 0.82 | KDM4E (0.63) | CYP3A4CYP2D6CYP2C9SCN9AALDH1A1 | |
| SCHEMBL1198019 | 0.80 | MEN1 (0.58) | CYP2C9ALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL7088488 | 0.80 | TSHR (0.59) | CYP3A4CYP2D6CYP2C9SCN9AALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0506194-B1 | 4-aryl-thiazole or imidazole derivatives | AKZO NOBEL NV (NL) | 1996-08-21 | — | — | EP | disclosed |
| US-5462959-A | 4-aryl-imidazole derivatives | AKZO N.V. (NL) | 1995-10-31 | — | — | US | disclosed |
| US-5254575-A | 4-aryl-thiazole derivatives | AKZO N.V. (NL) | 1993-10-19 | — | — | US | disclosed |
| EP-0506194-A1 | 4-aryl-thiazole or imidazole derivatives | Akzo Nobel N.V. (NL) | 1992-09-30 | — | — | EP | disclosed |