Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 2/20 | 0.53 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.53 |
| ▸ | ERN1 | O75460 | 4/20 | 0.44 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.43 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.43 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.43 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.43 |
| ▸ | CTSA | P10619 | 1/20 | 0.43 |
| ▸ | KDR | P35968 | 5/20 | 0.42 |
| ▸ | EPHB4 | P54760 | 2/20 | 0.42 |
| ▸ | TEK | Q02763 | 2/20 | 0.42 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.42 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.42 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.42 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1844195 | 0.85 | MKNK1 (0.50) | HSD17B1HSD17B2ERN1KDREPHB4 | |
| SCHEMBL13680798 | 0.84 | CYP1A2 (0.38) | HSD17B1HSD17B2KDRCYP1A2CYP3A4 | |
| SCHEMBL13680808 | 0.82 | EPHX2 (0.38) | PIK3CDPIK3CAPIK3CBPIK3CG | |
| SCHEMBL31689010 | 0.81 | FFAR1 (0.56) | HSD17B1HSD17B2CTSAMKNK1MKNK2 | |
| SCHEMBL18251117 | 0.80 | HSD17B1 (0.61) | HSD17B1HSD17B2PIK3CDPIK3CAPIK3CB | |
| SCHEMBL13680806 | 0.80 | CYP4F2 (0.50) | ERN1 | |
| SCHEMBL13680797 | 0.80 | CYP11B2 (0.38) | CYP2A6 | |
| SCHEMBL16675771 | 0.79 | HSD17B1 (0.64) | HSD17B1HSD17B2PIK3CDPIK3CAPIK3CB | |
| SCHEMBL13680784 | 0.79 | ABL1 (0.50) | — | |
| SCHEMBL13680849 | 0.76 | SCN9A (0.43) | HSD17B1HSD17B2ERN1PIK3CAMKNK1 |
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 |