Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRL1 | P41146 | 12/20 | 0.73 |
| ▸ | OPRM1 | P35372 | 11/20 | 0.73 |
| ▸ | OPRK1 | P41145 | 10/20 | 0.73 |
| ▸ | CTSS | P25774 | 1/20 | 0.49 |
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | HTR7 | P34969 | 1/20 | 0.46 |
| ▸ | SCN1A | P35498 | 1/20 | 0.45 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.45 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.45 |
| ▸ | AKT1 | P31749 | 1/20 | 0.45 |
| ▸ | AKT2 | P31751 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL1859464 | 0.90 | OPRL1 (0.86) | OPRL1OPRM1OPRK1CTSSHTR2A | |
| SCHEMBL181682 | 0.85 | OPRM1 (1.00) | OPRL1OPRM1OPRK1HTR2AHTR7 | |
| SCHEMBL12394836 | 0.81 | OPRM1 (0.58) | OPRL1OPRM1OPRK1CTSSAKT1 | |
| SCHEMBL3871435 | 0.80 | OPRL1 (0.68) | OPRL1OPRM1OPRK1 | |
| SCHEMBL1865303 | 0.80 | OPRL1 (0.79) | OPRL1OPRM1OPRK1 | |
| SCHEMBL14419015 | 0.80 | AKT1 (0.66) | OPRL1OPRM1OPRK1CTSSAKT1 | |
| SCHEMBL14419014 | 0.80 | AKT1 (0.66) | OPRL1OPRM1OPRK1CTSSAKT1 | |
| SCHEMBL14419016 | 0.80 | OPRM1 (0.58) | OPRL1OPRM1OPRK1CTSSAKT1 | |
| SCHEMBL1863856 | 0.78 | OPRM1 (0.76) | OPRL1OPRM1OPRK1HTR2AHTR7 | |
| SCHEMBL1860312 | 0.77 | OPRM1 (0.74) | OPRL1OPRM1OPRK1HTR2AHTR7 |
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 |
|---|---|---|---|---|---|---|---|
| US-7524850-B2 | 1-{1-[4-(6-hydroxy-5-isobutyl-3-phenylpyrazin-2-yl)benzyl]piperidin-4-yl}-1,3-dihydro-2H-benzimidazol-2-one; serine/threonine protein kinase; antiproliferative | MERCK & CO., INC. (US) | 2009-04-28 | — | — | US | disclosed |