Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALCRL | Q16602 | 7/20 | 0.58 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.55 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.55 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | RAMP1 | O60894 | 1/20 | 0.49 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.48 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.48 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.48 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.48 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.48 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.48 |
| ▸ | PLD2 | O14939 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL4698559 | 0.86 | CALCRL (0.65) | CALCRLOPRM1OPRK1OPRL1CYP3A4 | |
| SCHEMBL4698557 | 0.86 | CALCRL (0.65) | CALCRLOPRM1OPRK1OPRL1CYP3A4 | |
| SCHEMBL12658316 | 0.77 | CHRM1 (0.61) | OPRM1OPRK1OPRL1ALDH1A1MAPK1 | |
| SCHEMBL13101545 | 0.77 | OPRM1 (0.57) | CALCRLOPRM1OPRK1OPRL1ALDH1A1 | |
| SCHEMBL1832853 | 0.76 | OPRM1 (0.52) | CALCRLOPRM1OPRK1OPRL1CYP3A4 | |
| SCHEMBL1832858 | 0.76 | OPRM1 (0.52) | CALCRLOPRM1OPRK1OPRL1CYP3A4 | |
| SCHEMBL22588021 | 0.75 | OPRK1 (0.67) | CALCRLOPRM1OPRK1OPRL1CYP3A4 | |
| SCHEMBL1833332 | 0.74 | HSD11B1 (0.68) | OPRM1OPRK1OPRL1ALDH1A1MAPK1 | |
| SCHEMBL1760919 | 0.73 | HSD11B1 (0.67) | OPRM1OPRK1OPRL1ALDH1A1MAPK1 | |
| Hydrochloric Acid SCHEMBL3106327 | 0.73 | HSD11B1 (0.67) | OPRM1OPRK1OPRL1ALDH1A1MAPK1 |
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-1330451-B1 | SUBSTITUTED BENZIMIDAZOL-2-ONES AS VASOPRESSIN RECEPTOR ANTAGONISTS AND NEUROPEPTIDE Y MODULATORS | ORTHO MCNEIL PHARM INC (US) | 2008-01-23 | — | — | EP | claimed |