Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 9/20 | 0.57 |
| ▸ | OPRD1 | P41143 | 8/20 | 0.57 |
| ▸ | OPRL1 | P41146 | 8/20 | 0.57 |
| ▸ | OPRK1 | P41145 | 7/20 | 0.57 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.46 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.46 |
| ▸ | CACNB1 | Q02641 | 1/20 | 0.46 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.46 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.42 |
| ▸ | KDM1A | O60341 | 2/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | TDO2 | P48775 | 1/20 | 0.40 |
| ▸ | ACP3 | P15309 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6889358 | 0.85 | OPRM1 (0.54) | OPRM1OPRD1OPRL1OPRK1CACNA2D1 | |
| SCHEMBL6899043 | 0.84 | OPRL1 (0.67) | OPRM1OPRD1OPRL1OPRK1CACNA2D1 | |
| SCHEMBL4166200 | 0.79 | OPRM1 (0.43) | OPRM1OPRD1OPRL1OPRK1USP2 | |
| SCHEMBL17048541 | 0.78 | OPRM1 (0.40) | OPRM1OPRD1OPRL1OPRK1CYP2D6 | |
| SCHEMBL17056170 | 0.76 | TACR1 (0.39) | OPRM1OPRD1OPRL1OPRK1CACNA2D1 | |
| SCHEMBL6895386 | 0.74 | OPRM1 (0.43) | OPRM1OPRD1OPRL1OPRK1SLC6A4 | |
| SCHEMBL6778892 | 0.74 | OPRM1 (0.56) | OPRM1OPRD1OPRL1OPRK1CACNA2D1 | |
| SCHEMBL6774471 | 0.73 | OPRK1 (0.48) | OPRM1OPRD1OPRL1OPRK1USP2 | |
| SCHEMBL6780265 | 0.72 | OPRM1 (0.50) | OPRM1OPRD1OPRL1OPRK1CACNA2D1 | |
| SCHEMBL6780954 | 0.70 | OPRL1 (0.69) | OPRM1OPRD1OPRL1OPRK1CACNA2D1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6831078-B1 | 3-aryl substituted having halo or alkylhalo groups; anxiety, epilepsy; presurgery muscle relaxant | VERNALIS RESEARCH LIMITED (GB) | 2004-12-14 | — | — | US | disclosed |
| EP-1049670-B1 | AZETIDINECARBOXAMIDE DERIVATIVES FOR TREATING CNS DISORDERS | VERNALIS RES LTD (GB) | 2002-07-17 | — | — | EP | disclosed |
| EP-1196165-A2 | AZETIDINE COMPOUNDS IN CNS AND EYE DISEASES | VERNALIS RESEARCH LIMITED (GB) | 2002-04-17 | — | — | EP | disclosed |
| WO-2001007022-A2 | AZETIDINE COMPOUNDS IN CNS AND EYE DISEASES | VERNALIS RESEARCH LIMITED (GB) | 2001-02-01 | — | — | WO | disclosed |
| EP-1049670-A1 | AZETIDINECARBOXAMIDE DERIVATIVES FOR TREATING CNS DISORDERS | VERNALIS RESEARCH LIMITED (GB) | 2000-11-08 | — | — | EP | disclosed |
| WO-1999037613-A1 | AZETIDINECARBOXAMIDE DERIVATIVES FOR TREATING CNS DISORDERS | VERNALIS RESEARCH LIMITED (GB) | 1999-07-29 | — | — | WO | disclosed |