Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.51 |
| ▸ | BRD4 | O60885 | 1/20 | 0.50 |
| ▸ | FYN | P06241 | 1/20 | 0.49 |
| ▸ | CCR1 | P32246 | 1/20 | 0.48 |
| ▸ | CCR8 | P51685 | 1/20 | 0.48 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.48 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.48 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.45 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.44 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.44 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.44 |
| ▸ | BPTF | Q12830 | 1/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | GUSB | P08236 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL13680450 | 0.78 | CA12 (0.53) | TGFBR1CCR1CCR8CYP2A6CA12 | |
| SCHEMBL13680563 | 0.78 | TGFBR1 (0.77) | TGFBR1 | |
| SCHEMBL4873744 | 0.77 | TGFBR1 (0.42) | NPC1TGFBR1BRD4FYNADORA2A | |
| SCHEMBL13680562 | 0.76 | CDK8 (0.58) | BRD4 | |
| SCHEMBL17149330 | 0.76 | IMPDH2 (0.54) | NPC1BRD4FYNADORA2AADORA1 | |
| SCHEMBL7330846 | 0.76 | NPC1 (0.58) | NPC1BRD4FYNADORA2AADORA1 | |
| SCHEMBL9231655 | 0.76 | NPC1 (0.68) | NPC1BRD4FYNADORA2AADORA1 | |
| SCHEMBL11990860 | 0.76 | CCR1 (0.68) | TGFBR1CCR1CCR8CYP2A6 | |
| SCHEMBL13680558 | 0.75 | GRIA1 (0.59) | TGFBR1CCR1CCR8CYP2A6 | |
| SCHEMBL5850255 | 0.75 | NPC1 (0.79) | NPC1BRD4FYNNISCHCYP17A1 |
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 |