Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B3 | P37058 | 14/20 | 0.53 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | CGAS | Q8N884 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL15062968 | 1.00 | HSD17B3 (0.53) | HSD17B3NOTUML3MBTL1CGASKDM4E | |
| SCHEMBL15063092 | 0.93 | HSD17B3 (0.55) | HSD17B3NOTUML3MBTL1 | |
| SCHEMBL15063091 | 0.93 | HSD17B3 (0.55) | HSD17B3NOTUML3MBTL1 | |
| SCHEMBL15062912 | 0.90 | HSD17B3 (0.50) | HSD17B3NOTUMKDM4E | |
| SCHEMBL15062911 | 0.90 | HSD17B3 (0.50) | HSD17B3NOTUMKDM4E | |
| SCHEMBL5046141 | 0.89 | HSD17B3 (0.43) | HSD17B3NOTUML3MBTL1CGASKDM4E | |
| SCHEMBL5046143 | 0.89 | HSD17B3 (0.43) | HSD17B3NOTUML3MBTL1CGASKDM4E | |
| SCHEMBL4803471 | 0.83 | HSD17B3 (0.69) | HSD17B3 | |
| SCHEMBL4803463 | 0.83 | HSD17B3 (0.69) | HSD17B3 | |
| SCHEMBL15063058 | 0.83 | HSD17B3 (0.56) | HSD17B3NOTUMKDM4E |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1725565-B1 | FUSED HETEROTRICYCLIC COMPOUNDS AS INHIBITORS OF 17B-HYDROXYSTEROID DEHYDROGENASE 3 | BRISTOL MYERS SQUIBB CO (US) | 2013-07-03 | — | — | EP | disclosed |