Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | CCR1 | P32246 | 1/20 | 0.41 |
| ▸ | CCR8 | P51685 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 4/20 | 0.39 |
| ▸ | MAOB | P27338 | 4/20 | 0.39 |
| ▸ | TGFBR1 | P36897 | 6/20 | 0.37 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.37 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.37 |
| ▸ | ACVR1B | P36896 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2615988 | 0.75 | RAB9A (0.56) | CCR1CCR8TGFBR1MAPK14RIPK2 | |
| SCHEMBL13680623 | 0.74 | NPC1 (0.41) | CYP2A6TGFBR1 | |
| SCHEMBL4761923 | 0.74 | ALDH1A1 (0.48) | MAOAMAOBTGFBR1 | |
| SCHEMBL13680566 | 0.73 | PRF1 (0.52) | — | |
| SCHEMBL27439272 | 0.73 | MAOA (0.40) | MAOAMAOB | |
| SCHEMBL13680572 | 0.72 | GRIA1 (0.62) | TGFBR1 | |
| SCHEMBL15984797 | 0.72 | NPC1 (0.57) | CCR1CCR8TGFBR1MAPK14RIPK2 | |
| SCHEMBL15849494 | 0.72 | TGFBR1 (0.62) | TGFBR1MAPK14RIPK2ACVR1BTDP1 | |
| SCHEMBL13680668 | 0.71 | CYP1A2 (0.50) | CYP2A6CCR1CCR8TGFBR1 | |
| SCHEMBL31432603 | 0.70 | CA12 (0.48) | MAOAMAOB |
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 |