Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 11/20 | 0.57 |
| ▸ | CYP26A1 | O43174 | 2/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.57 |
| ▸ | CYP24A1 | Q07973 | 1/20 | 0.57 |
| ▸ | CYP26B1 | Q9NR63 | 1/20 | 0.57 |
| ▸ | FNTA | P49354 | 1/20 | 0.44 |
| ▸ | FNTB | P49356 | 1/20 | 0.44 |
| ▸ | CNR1 | P21554 | 3/20 | 0.42 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.38 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.38 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.38 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9194639 | 0.93 | CYP19A1 (0.56) | CYP19A1CYP26A1CYP3A4CYP2C8CYP2D6 | |
| Water SCHEMBL9727730 | 0.85 | CYP19A1 (0.61) | CYP19A1CYP26A1CYP3A4CYP2C8CYP2D6 | |
| SCHEMBL10102763 | 0.83 | CYP19A1 (0.57) | CYP19A1CYP26A1CYP3A4CYP2C8CYP2D6 | |
| SCHEMBL9192629 | 0.82 | CYP17A1 (0.43) | CYP26A1CYP3A4CYP17A1 | |
| SCHEMBL12336821 | 0.81 | CYP19A1 (0.52) | CYP19A1CYP26A1CYP3A4CYP2C8CYP2D6 | |
| SCHEMBL12336931 | 0.80 | CYP11B1 (0.46) | CYP19A1CYP26A1CYP3A4CYP2C8CYP2D6 | |
| SCHEMBL9198108 | 0.78 | CYP19A1 (0.60) | CYP19A1CYP26A1CYP3A4CYP2C8CYP2D6 | |
| SCHEMBL10102687 | 0.77 | CYP19A1 (0.64) | CYP19A1CYP26A1CYP3A4CYP2C8CYP2D6 | |
| SCHEMBL1626417 | 0.77 | CYP19A1 (0.55) | CYP19A1CYP26A1CYP3A4CYP2C8CYP2D6 | |
| SCHEMBL12337076 | 0.76 | CYP19A1 (0.53) | CYP19A1CYP26A1CYP3A4CYP2C8CYP2D6 |
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-0371564-B1 | (1H-azol-1-ylmethyl)substituted quinoline, quinazoline or quinoxaline derivatives | JANSSEN PHARMACEUTICA NV (BE) | 1995-07-12 | — | — | EP | disclosed |
| US-5151421-A | Compounds for inhibition of metabolism of retinoids, for treatment for proliferation of epithelial cells and keratin disorders | JANSSEN PHARMACEUTICA N.V. (BE) | 1992-09-29 | — | — | US | disclosed |
| US-5028606-A | Retinoid metabolism inhibitors | JANSSEN PHARMACEUTICA N.V. (BE) | 1991-07-02 | — | — | US | disclosed |