Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 4/20 | 0.42 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.42 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.40 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.39 |
| ▸ | AR | P10275 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | ICMT | O60725 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.37 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.36 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1507856 | 0.91 | KIF11 (0.45) | CYP19A1CYP11B1CYP11B2MAPKAPK2AR | |
| SCHEMBL5597319 | 0.86 | CYP2E1 (0.46) | CYP19A1CYP11B1CYP11B2ARHRH3 | |
| SCHEMBL27325095 | 0.83 | PDE4A (0.45) | CYP19A1CYP11B2MAPKAPK2ICMTCYP2A6 | |
| Hydrochloric Acid SCHEMBL10845333 | 0.80 | CYP19A1 (0.40) | CYP19A1MAPKAPK2ICMTCYP1A2CYP2D6 | |
| SCHEMBL10735832 | 0.80 | CYP19A1 (0.37) | CYP19A1CYP11B1CYP11B2LOXL2HRH3 | |
| SCHEMBL8411283 | 0.78 | CYP19A1 (0.47) | CYP19A1CYP11B1CYP11B2ARKDM4E | |
| SCHEMBL8408613 | 0.78 | CYP19A1 (0.47) | CYP19A1CYP11B1CYP11B2ARKDM4E | |
| SCHEMBL1508003 | 0.78 | CYP19A1 (0.50) | CYP19A1CYP11B1CYP11B2 | |
| SCHEMBL6981310 | 0.76 | HSP90AA1 (0.42) | CYP19A1CYP11B1CYP11B2 | |
| Benzene SCHEMBL20549155 | 0.75 | L3MBTL1 (0.53) | ALDH1A1CYP1A2CYP2D6CYP2C9HPGD |
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-1492515-A1 | PHARMACEUTICAL COMPOSITION COMPRISING AN AROMATASE INHIBITOR AND AN ESTROGEN SUITABLE FOR HORMONE REPLACEMENT THERAPY FOR A MALE | JENCAP RESEARCH LTD. (CA) | 2005-01-05 | — | — | EP | disclosed |
| WO-2003082254-A1 | PHARMACEUTICAL COMPOSITION COMPRISING AN AROMATASE INHIBITOR AND AN ESTROGEN SUITABLE FOR HORMONE REPLACEMENT THERAPY FOR A MALE | JENCAP RESEARCH LTD. (CA) | 2003-10-09 | — | — | WO | disclosed |
| EP-0236940-A2 | Alpha-heterocycle substituted tolunitriles | CIBA-GEIGY AG (CH) | 1987-09-16 | — | — | EP | disclosed |