Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 6/20 | 0.56 |
| ▸ | CYP11B1 | P15538 | 5/20 | 0.56 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.56 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.46 |
| ▸ | RELA | Q04206 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.41 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.41 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6660192 | 0.91 | CYP11B1 (0.57) | CYP11B2CYP11B1CYP19A1TP53SMN1; SMN2 | |
| SCHEMBL6840530 | 0.91 | CYP11B2 (0.56) | CYP11B2CYP11B1CYP19A1TP53SMN1; SMN2 | |
| SCHEMBL6656508 | 0.86 | CYP11B2 (0.53) | CYP11B2CYP11B1CYP19A1SMN1; SMN2NPC1 | |
| SCHEMBL6661401 | 0.84 | CYP11B1 (0.49) | CYP11B2CYP11B1CYP19A1SMN1; SMN2NPC1 | |
| SCHEMBL6663687 | 0.82 | CYP11B2 (0.49) | CYP11B2CYP11B1CYP19A1TP53SMN1; SMN2 | |
| SCHEMBL6846113 | 0.82 | CYP11B2 (0.48) | CYP11B2CYP11B1CYP19A1CYP3A4CYP17A1 | |
| SCHEMBL6655119 | 0.82 | CYP11B2 (0.51) | CYP11B2CYP11B1CYP19A1CYP3A4CYP17A1 | |
| SCHEMBL6846125 | 0.81 | CYP11B2 (0.59) | CYP11B2CYP11B1CYP19A1CYP3A4ALDH1A1 | |
| SCHEMBL6682744 | 0.80 | CYP11B2 (0.50) | CYP11B2CYP11B1CYP19A1CYP3A4CYP17A1 | |
| SCHEMBL22515748 | 0.80 | CYP11B2 (0.49) | CYP11B2CYP11B1CYP19A1CYP3A4CYP17A1 |
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-1432698-A2 | SUBSTITUTED 3-PYRIDYL INDOLES AND INDAZOLES AS C17,20 LYASE INHIBITORS | Bayer Pharmaceuticals Corporation (US) | 2004-06-30 | — | — | EP | disclosed |
| WO-2003027094-A2 | SUBSTITUTED 3-PYRIDYL INDOLES AND INDAZOLES AS C17,20 LYASE INHIBITORS | BAYER PHARMACEUTICALS CORPORATION (US) | 2003-04-03 | — | — | WO | disclosed |