Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | CCR1 | P32246 | 1/20 | 0.43 |
| ▸ | CCR8 | P51685 | 1/20 | 0.43 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.41 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.39 |
| ▸ | BRS3 | P32247 | 1/20 | 0.39 |
| ▸ | TGFBR1 | P36897 | 6/20 | 0.38 |
| ▸ | GRM5 | P41594 | 1/20 | 0.38 |
| ▸ | METAP2 | P50579 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.36 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30146649 | 0.81 | CYP2A6 (0.51) | CYP2A6CCR1CCR8TGFBR1CYP1A2 | |
| SCHEMBL13680484 | 0.81 | CYP2A6 (0.51) | CYP2A6CCR1CCR8TGFBR1CYP1A2 | |
| SCHEMBL12269975 | 0.79 | CYP19A1 (0.50) | CYP2A6CCR1CCR8SCN9ABRS3 | |
| SCHEMBL10203331 | 0.78 | SCN10A (0.53) | CYP2A6CCR1CCR8SCN10ATGFBR1 | |
| SCHEMBL13680557 | 0.77 | TRPV3 (0.51) | CYP2A6CCR1CCR8SCN9ATGFBR1 | |
| SCHEMBL30146674 | 0.76 | CYP2A6 (0.65) | CYP2A6CCR1CCR8TGFBR1GRM5 | |
| SCHEMBL3421947 | 0.76 | CYP2A6 (0.65) | CYP2A6CCR1CCR8TGFBR1GRM5 | |
| SCHEMBL13680845 | 0.75 | SCN9A (0.41) | SCN9ACYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL13680445 | 0.75 | HSD17B1 (0.46) | SCN10A | |
| SCHEMBL13680479 | 0.74 | CYP2A6 (0.54) | CYP2A6CCR1CCR8TGFBR1GRM5 |
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 |