Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 10/20 | 0.56 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.53 |
| ▸ | USP2 | O75604 | 1/20 | 0.53 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | PGR | P06401 | 1/20 | 0.53 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | IDO1 | P14902 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | MAOA | P21397 | 1/20 | 0.53 |
| ▸ | CNR1 | P21554 | 1/20 | 0.53 |
| ▸ | HTR2A | P28223 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL9664901 | 0.83 | CYP19A1 (0.53) | CYP19A1CYP17A1MEN1NR1I2USP2 | |
| SCHEMBL3279238 | 0.80 | CYP19A1 (0.60) | CYP19A1CYP17A1MEN1NR1I2USP2 | |
| Water SCHEMBL9728138 | 0.78 | CYP19A1 (0.61) | CYP19A1CYP17A1MEN1NR1I2USP2 | |
| SCHEMBL9664795 | 0.77 | CYP19A1 (0.55) | CYP19A1CYP17A1MEN1NR1I2USP2 | |
| SCHEMBL9664219 | 0.77 | CYP17A1 (0.59) | CYP17A1MEN1NR1I2USP2ABCB11 | |
| SCHEMBL2352227 | 0.76 | CYP19A1 (0.58) | CYP19A1CYP17A1MEN1NR1I2USP2 | |
| SCHEMBL9195873 | 0.76 | CYP19A1 (0.58) | CYP19A1CYP17A1MEN1NR1I2USP2 | |
| Irtemazole SCHEMBL636285 | 0.75 | CYP26A1 (0.57) | CYP19A1CYP17A1MEN1NR1I2USP2 | |
| SCHEMBL9196154 | 0.75 | CYP19A1 (0.69) | CYP19A1CYP17A1MEN1NR1I2USP2 | |
| SCHEMBL3279898 | 0.75 | CYP19A1 (0.60) | CYP19A1CYP17A1MEN1NR1I2USP2 |
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-0260744-B1 | (1H-IMIDAZOL-1-YLMETHYL) SUBSTITUTED BENZIMIDAZOLE DERIVATIVES | JANSSEN PHARMACEUTICA N.V. (BE) | 1992-12-16 | — | — | EP | disclosed |
| US-4859684-A | (1H-imidazol-1-ylmethyl) substituted benzimidazole derivatives and use thereof in treating androgen dependent disorders | JANSSEN PHARMACEUTICA N.V. (BE) | 1989-08-22 | — | — | US | disclosed |
| EP-0260744-A2 | (1H-imidazol-1-ylmethyl) substituted benzimidazole derivatives | JANSSEN PHARMACEUTICA N.V. (BE) | 1988-03-23 | — | — | EP | disclosed |