Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.51 |
| ▸ | CA2 | P00918 | 2/20 | 0.51 |
| ▸ | CA9 | Q16790 | 2/20 | 0.51 |
| ▸ | CA12 | O43570 | 1/20 | 0.51 |
| ▸ | MKNK1 | Q9BUB5 | 3/20 | 0.49 |
| ▸ | MKNK2 | Q9HBH9 | 3/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | KIF11 | P52732 | 1/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 5/20 | 0.44 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.44 |
| ▸ | CYP17A1 | P05093 | 3/20 | 0.44 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.44 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5532552 | 0.83 | CA2 (0.62) | CA1CA2CA9CA12KIF11 | |
| SCHEMBL24360466 | 0.83 | CA2 (0.62) | CA1CA2CA9CA12KIF11 | |
| SCHEMBL835233 | 0.82 | PTGS2 (0.40) | CYP19A1CYP3A4CYP2A6CYP1A2CYP11B2 | |
| SCHEMBL29462392 | 0.82 | PTGS1 (0.46) | CA1CA2CA9CA12CYP19A1 | |
| SCHEMBL3718580 | 0.82 | PTGS1 (0.46) | CA1CA2CA9CA12CYP19A1 | |
| SCHEMBL1713465 | 0.81 | KIF11 (0.55) | CA1CA2CA9CA12KIF11 | |
| SCHEMBL6801382 | 0.81 | CA2 (0.66) | CA1CA2CA9CA12MKNK1 | |
| SCHEMBL1805795 | 0.79 | CYP11B1 (0.48) | MKNK1MKNK2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL24360467 | 0.78 | CA2 (0.56) | CA1CA2CA9CA12KIF11 | |
| SCHEMBL1772727 | 0.78 | TBXAS1 (0.43) | CYP2D6CYP2A6CYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0360369-B1 | 11-Beta-phenyl-14-beta-H-steroids | SCHERING AG (DE) | 1995-05-03 | — | — | EP | disclosed |
| EP-0360369-A1 | 11-Beta-phenyl-14-beta-H-steroids | SCHERING AKTIENGESELLSCHAFT (DE) | 1990-03-28 | — | — | EP | disclosed |