Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALCRL | Q16602 | 12/20 | 0.65 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.60 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.55 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.55 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.55 |
| ▸ | RAMP1 | O60894 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.52 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.51 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.51 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.51 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.51 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.51 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
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 | 1.00 | CALCRL (0.65) | CALCRLCYP3A4OPRM1OPRK1OPRL1 | |
| SCHEMBL4698619 | 0.86 | CALCRL (0.58) | CALCRLCYP3A4OPRM1OPRK1OPRL1 | |
| SCHEMBL3963833 | 0.81 | CALCRL (0.81) | CALCRLCYP3A4RAMP1ALDH1A1MAPK1 | |
| SCHEMBL6808345 | 0.80 | CALCRL (0.63) | CALCRLCYP3A4OPRM1RAMP1ALDH1A1 | |
| SCHEMBL12658316 | 0.79 | CHRM1 (0.61) | OPRM1OPRK1OPRL1ALDH1A1MAPK1 | |
| SCHEMBL6802711 | 0.78 | CALCRL (0.63) | CALCRLCYP3A4OPRM1RAMP1ALDH1A1 | |
| SCHEMBL22588021 | 0.77 | OPRK1 (0.67) | CALCRLCYP3A4OPRM1OPRK1OPRL1 | |
| SCHEMBL13609531 | 0.77 | CALCRL (0.55) | CALCRLCYP3A4RAMP1ALDH1A1MAPK1 | |
| SCHEMBL8279362 | 0.77 | ITGB1 (0.64) | CALCRLCYP3A4OPRM1OPRK1RAMP1 | |
| SCHEMBL1833332 | 0.76 | HSD11B1 (0.68) | 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 |