Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 4/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.46 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | CASP7 | P55210 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | PGR | P06401 | 1/20 | 0.44 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.40 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 8/20 | 0.39 |
| ▸ | GRM5 | P41594 | 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 | |
|---|---|---|---|---|
| SCHEMBL28655414 | 0.77 | HSD17B1 (0.78) | HSD17B1CYP1A2CYP11B1CYP11B2CASP1 | |
| SCHEMBL13680592 | 0.77 | PRF1 (0.55) | — | |
| SCHEMBL13680593 | 0.76 | CLK4 (0.56) | GSK3BGRM5 | |
| SCHEMBL1747435 | 0.75 | HSD17B1 (0.69) | HSD17B1CYP1A2CYP11B1CYP11B2CASP1 | |
| SCHEMBL13681001 | 0.75 | HSD17B1 (0.44) | HSD17B1CYP1A2CYP11B1CYP11B2CASP1 | |
| SCHEMBL19100757 | 0.73 | HSD17B1 (0.62) | HSD17B1CYP1A2CYP11B1CYP11B2CASP1 | |
| SCHEMBL13680642 | 0.71 | PARP10 (0.64) | HSD17B1CYP1A2CYP11B1CYP11B2CASP1 | |
| SCHEMBL3630871 | 0.71 | HSD17B1 (0.54) | HSD17B1CYP1A2CYP11B1CYP11B2CASP1 | |
| SCHEMBL13680591 | 0.71 | GSK3B (0.39) | GSK3B | |
| SCHEMBL29726014 | 0.70 | CASP1 (0.59) | HSD17B1CYP1A2CYP11B1CYP11B2CASP1 |
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 |