Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 1/20 | 0.42 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.42 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
| ▸ | CCKBR | P32239 | 12/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.33 |
| ▸ | MTNR1B | P49286 | 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 | |
|---|---|---|---|---|
| SCHEMBL8922475 | 1.00 | HSD17B1 (0.42) | HSD17B1HSD17B2GRIN2BCCKBROPRM1 | |
| SCHEMBL8919393 | 0.95 | GRIN2B (0.38) | HSD17B1HSD17B2GRIN2BCCKBROPRM1 | |
| SCHEMBL8919398 | 0.95 | GRIN2B (0.38) | HSD17B1HSD17B2GRIN2BCCKBROPRM1 | |
| SCHEMBL8922834 | 0.93 | CCKBR (0.41) | HSD17B1HSD17B2GRIN2BCCKBROPRM1 | |
| SCHEMBL8922831 | 0.93 | CCKBR (0.41) | HSD17B1HSD17B2GRIN2BCCKBROPRM1 | |
| SCHEMBL8921207 | 0.93 | GRIN2B (0.37) | HSD17B1HSD17B2GRIN2BCCKBROPRM1 | |
| SCHEMBL8921200 | 0.93 | GRIN2B (0.37) | HSD17B1HSD17B2GRIN2BCCKBROPRM1 | |
| SCHEMBL8921462 | 0.93 | GRIN2B (0.35) | HSD17B1HSD17B2GRIN2BCCKBROPRM1 | |
| SCHEMBL8920632 | 0.93 | CCKBR (0.41) | HSD17B1HSD17B2GRIN2BCCKBROPRM1 | |
| SCHEMBL8920628 | 0.93 | CCKBR (0.41) | HSD17B1HSD17B2GRIN2BCCKBROPRM1 |
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-5643904-A | Substituted hexahdryoazepinones and tetrahydrobenzazepinones | PFIZER INC. (US) | 1997-07-01 | — | — | US | disclosed |
| WO-1993015059-A1 | 3-PHENYLUREIDO-AZEPIN-2-ONES AND -BENZAZEPIN-2-ONES USEFUL AS CHOLECYSTOKININ ANTAGONISTS | PFIZER INC. (US) | 1993-08-05 | — | — | WO | disclosed |