Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 16/20 | 0.75 |
| ▸ | AKT2 | P31751 | 15/20 | 0.75 |
| ▸ | AKT3 | Q9Y243 | 8/20 | 0.75 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.64 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.64 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.64 |
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 | |
|---|---|---|---|---|
| SCHEMBL3979811 | 1.00 | AKT1 (0.75) | AKT1AKT2AKT3OPRM1OPRK1 | |
| SCHEMBL3979061 | 0.92 | AKT1 (0.77) | AKT1AKT2AKT3OPRM1OPRK1 | |
| SCHEMBL3980608 | 0.92 | AKT1 (0.77) | AKT1AKT2AKT3OPRM1OPRK1 | |
| SCHEMBL2437301 | 0.90 | AKT1 (0.78) | AKT1AKT2AKT3 | |
| SCHEMBL2441673 | 0.90 | AKT1 (0.78) | AKT1AKT2AKT3 | |
| SCHEMBL3978936 | 0.89 | AKT1 (0.77) | AKT1AKT2AKT3OPRM1OPRK1 | |
| SCHEMBL3983210 | 0.89 | AKT1 (0.77) | AKT1AKT2AKT3OPRM1OPRK1 | |
| SCHEMBL2472904 | 0.86 | AKT1 (0.66) | AKT1AKT2AKT3 | |
| SCHEMBL2470952 | 0.86 | AKT1 (0.66) | AKT1AKT2AKT3 | |
| SCHEMBL5348455 | 0.86 | AKT1 (1.00) | AKT1AKT2AKT3OPRM1OPRK1 |
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 | claimed |