Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.49 |
| ▸ | TGFBR1 | P36897 | 4/20 | 0.42 |
| ▸ | TGFBR2 | P37173 | 1/20 | 0.42 |
| ▸ | GRM5 | P41594 | 3/20 | 0.42 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MAP3K20 | Q9NYL2 | 1/20 | 0.39 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | HTR7 | P34969 | 1/20 | 0.39 |
| ▸ | GRM1 | Q13255 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6655119 | 0.83 | CYP11B2 (0.51) | CYP2A6CYP11B1CYP11B2CYP2E1CYP3A4 | |
| SCHEMBL6846125 | 0.82 | CYP11B2 (0.59) | MAPTCYP2A6CYP11B1CYP11B2CYP3A4 | |
| SCHEMBL6960921 | 0.82 | KCNH2 (0.49) | MAPTTGFBR1GRM5NPC1RAB9A | |
| SCHEMBL22515748 | 0.81 | CYP11B2 (0.49) | CYP2A6CYP11B1CYP11B2CYP2E1CYP3A4 | |
| SCHEMBL6846113 | 0.81 | CYP11B2 (0.48) | MAPTCYP2A6CYP11B1CYP11B2CYP2E1 | |
| SCHEMBL6657591 | 0.80 | CYP11B2 (0.56) | CYP2A6CYP11B1CYP11B2CYP3A4KDM4C | |
| SCHEMBL6652718 | 0.80 | CYP2E1 (0.43) | MAPTCYP2A6CYP11B1CYP11B2CYP2E1 | |
| SCHEMBL22515743 | 0.79 | CYP11B2 (0.53) | CYP2A6CYP11B1CYP11B2 | |
| SCHEMBL6682744 | 0.79 | CYP11B2 (0.50) | MAPTCYP2A6CYP11B1CYP11B2CYP2E1 | |
| SCHEMBL6656090 | 0.78 | CYP11B2 (0.50) | MAPTCYP11B1CYP11B2CYP3A4 |
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 |