Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 16/20 | 0.49 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.48 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.48 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.47 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8729119 | 1.00 | ACACB (0.49) | ACACBITGB3ITGA2BADRB2ADRB3 | |
| SCHEMBL8729003 | 1.00 | ACACB (0.49) | ACACBITGB3ITGA2BADRB2ADRB3 | |
| SCHEMBL8729106 | 0.87 | ADRB3 (0.49) | ACACBITGB3ITGA2BADRB3HDAC8 | |
| SCHEMBL8729115 | 0.87 | ADRB3 (0.49) | ACACBITGB3ITGA2BADRB3HDAC8 | |
| SCHEMBL8729117 | 0.84 | HDAC8 (0.47) | ACACBITGB3ITGA2BADRB3HDAC8 | |
| SCHEMBL8727035 | 0.84 | ACACB (0.46) | ACACBITGB3ITGA2BADRB3HDAC8 | |
| SCHEMBL8733831 | 0.84 | ACACB (0.45) | ACACBITGB3ITGA2BHDAC8 | |
| SCHEMBL8732422 | 0.82 | HDAC8 (0.53) | ACACBITGB3ITGA2BADRB2ADRB3 | |
| SCHEMBL15764483 | 0.82 | ACACB (0.62) | ACACBITGB3ITGA2B | |
| SCHEMBL8732428 | 0.82 | HDAC8 (0.53) | ACACBITGB3ITGA2BADRB2ADRB3 |
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-5726165-A | HYPOGLYCEMIC AGENTS; DIETETICS; GASTROINTESTINAL DISORDERS | SMITHKLINE BEECHAM P.L.C. (GB) | 1998-03-10 | — | — | US | disclosed |
| WO-1996004234-A1 | ARYLOXY ANDARYCTHIO PROPANOLAMINE DERIVATIVES USEFUL AS B3-ADRENORECEPTOR AGONISTS AND ANTAGONS OF THE B1 AND B2 ADRENORECEPTORS AND PHARMACEUTICAL COMPOSITION THEREOF | SMITHKLINE BEECHAM PLC (GB) | 1996-02-15 | — | — | WO | disclosed |