Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 8/20 | 0.52 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.46 |
| ▸ | CYP26A1 | O43174 | 8/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10699600 | 0.88 | CYP26A1 (0.52) | CYP17A1CYP11B1CYP11B2CYP26A1CYP19A1 | |
| SCHEMBL9078342 | 0.85 | CYP17A1 (0.58) | CYP17A1CYP11B1CYP11B2CYP26A1CYP19A1 | |
| SCHEMBL10700894 | 0.80 | CYP19A1 (0.60) | CYP17A1CYP11B1CYP11B2CYP26A1CYP19A1 | |
| SCHEMBL9728006 | 0.79 | CYP17A1 (0.47) | CYP17A1CYP11B1CYP11B2CYP26A1CYP19A1 | |
| SCHEMBL4054853 | 0.77 | CYP17A1 (0.68) | CYP17A1CYP11B1CYP11B2CYP26A1CYP19A1 | |
| SCHEMBL9190551 | 0.73 | CYP19A1 (0.50) | CYP17A1CYP11B1CYP11B2CYP26A1CYP19A1 | |
| SCHEMBL9664721 | 0.73 | CYP26A1 (0.48) | CYP17A1CYP11B1CYP11B2CYP26A1CYP19A1 | |
| Fluorobenzene SCHEMBL10576700 | 0.73 | CYP17A1 (0.48) | CYP17A1CYP11B1CYP11B2CYP26A1CYP19A1 | |
| SCHEMBL9190836 | 0.72 | CYP17A1 (0.57) | CYP17A1CYP11B1CYP11B2CYP26A1CYP19A1 | |
| SCHEMBL9664941 | 0.72 | CYP26A1 (0.47) | CYP17A1CYP11B1CYP11B2CYP26A1 |
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-0260744-A2 | (1H-imidazol-1-ylmethyl) substituted benzimidazole derivatives | JANSSEN PHARMACEUTICA N.V. (BE) | 1988-03-23 | — | — | EP | disclosed |