Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 4/20 | 0.61 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.53 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.51 |
| ▸ | GRM5 | P41594 | 1/20 | 0.44 |
| ▸ | CDC25A | P30304 | 1/20 | 0.43 |
| ▸ | CDC25B | P30305 | 1/20 | 0.43 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.43 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.43 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.43 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.43 |
| ▸ | PIP5K1C | O60331 | 1/20 | 0.43 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.43 |
| ▸ | PI4KA | P42356 | 1/20 | 0.43 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.43 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.43 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.42 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL13680493 | 0.82 | CYP2A6 (0.47) | CYP19A1CYP2A6CYP2E1CYP3A4CYP2C9 | |
| SCHEMBL6840352 | 0.81 | CYP3A4 (0.64) | CYP19A1CYP2A6CYP2E1CYP3A4CYP2C9 | |
| SCHEMBL28731211 | 0.79 | CYP19A1 (0.56) | CYP19A1CYP2A6CDC25ACDC25BPDGFRB | |
| SCHEMBL28731315 | 0.79 | MAPT (0.65) | CYP19A1CYP2A6CDC25ACDC25BPDGFRB | |
| SCHEMBL18499144 | 0.79 | NPSR1 (0.45) | CYP19A1CYP2A6CYP2E1CYP3A4CYP2C9 | |
| SCHEMBL13680615 | 0.78 | CYP2E1 (0.47) | CYP19A1CYP2A6CYP2E1CYP3A4CYP2C9 | |
| SCHEMBL2141265 | 0.78 | ALDH1A1 (0.61) | CYP19A1CYP2A6MKNK1MKNK2CPT2 | |
| SCHEMBL27740381 | 0.77 | CYP19A1 (0.56) | CYP19A1CYP2A6MKNK1MKNK2CPT2 | |
| SCHEMBL2925411 | 0.77 | CYP19A1 (0.56) | CYP19A1CYP2A6PIK3CGMKNK1MKNK2 | |
| SCHEMBL13680530 | 0.77 | CYP2A6 (0.54) | CYP2A6CYP2E1CYP3A4CYP2C9CYP2B6 |
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 |
|---|---|---|---|---|---|---|---|
| US-7582658-B2 | Bicyclic compound | ASAHI KASEI PHARMA CORPORATION (JP) | 2009-09-01 | — | — | US | disclosed |
| US-7582658-B2 | Bicyclic compound | ASAHI KASEI PHARMA CORPORATION (JP) | 2009-09-01 | — | — | US | disclosed |