Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 5/20 | 0.51 |
| ▸ | PDE10A | Q9Y233 | 3/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.43 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.40 |
| ▸ | AXL | P30530 | 1/20 | 0.40 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.40 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.40 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.40 |
| ▸ | KARS1 | Q15046 | 1/20 | 0.39 |
| ▸ | CYP2E1 | P05181 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3854280 | 0.84 | MEN1 (0.50) | PDE10AALDH1A1RAB9A | |
| SCHEMBL13680847 | 0.79 | PDE10A (0.43) | CYP2A6PDE10AIRAK4NPC1RAB9A | |
| SCHEMBL15810185 | 0.79 | CYP2A6 (0.51) | CYP2A6PDE10AHSP90AA1HSP90AB1PTK2 | |
| SCHEMBL24701007 | 0.78 | CYP2A6 (0.57) | CYP2A6PDE10AHSP90AA1HSP90AB1PTK2 | |
| SCHEMBL2759492 | 0.78 | CYP2A6 (0.62) | CYP2A6PDE10AHSP90AA1HSP90AB1PTK2 | |
| SCHEMBL13680834 | 0.77 | PDE10A (0.39) | PDE10AALDH1A1IRAK4RAB9A | |
| SCHEMBL1272924 | 0.77 | CYP2A6 (0.53) | CYP2A6PDE10AHSP90AA1HSP90AB1PTK2 | |
| SCHEMBL1272922 | 0.77 | CYP2A6 (0.49) | CYP2A6PDE10AHSP90AA1HSP90AB1PTK2 | |
| SCHEMBL13680846 | 0.77 | MAPT (0.40) | CYP2A6PDE10ACYP2E1CYP2B6 | |
| SCHEMBL3194702 | 0.76 | CYP2A6 (0.74) | CYP2A6HSP90AA1HSP90AB1PTK2CYP19A1 |
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 |