Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 2/20 | 0.48 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.47 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.47 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.47 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.47 |
| ▸ | PRCP | P42785 | 9/20 | 0.45 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.43 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL19548078 | 0.94 | KCNH2 (0.54) | OPRM1OPRD1KCNH2CYP3A4CYP2C9 | |
| SCHEMBL1746897 | 0.94 | KCNH2 (0.54) | OPRM1OPRD1KCNH2CYP3A4CYP2C9 | |
| SCHEMBL14553283 | 0.93 | OPRM1 (0.49) | OPRM1OPRD1KCNH2CYP3A4CYP2C9 | |
| SCHEMBL27758910 | 0.89 | OPRM1 (0.47) | OPRM1OPRD1KCNH2CYP3A4CYP2C9 | |
| SCHEMBL27758903 | 0.89 | ALDH1A1 (0.47) | OPRM1OPRD1KCNH2CYP3A4CYP2C9 | |
| SCHEMBL1745425 | 0.88 | CYP3A4 (0.57) | OPRM1OPRD1KCNH2CYP3A4CYP2C9 | |
| SCHEMBL9284875 | 0.88 | KCNH2 (0.55) | OPRM1OPRD1KCNH2CYP3A4CYP2C9 | |
| SCHEMBL1747173 | 0.87 | CYP3A4 (0.56) | OPRM1OPRD1KCNH2CYP3A4CYP2C9 | |
| SCHEMBL1747178 | 0.87 | CYP3A4 (0.56) | OPRM1OPRD1KCNH2CYP3A4CYP2C9 | |
| SCHEMBL27758921 | 0.86 | KCNH2 (0.48) | OPRM1OPRD1KCNH2CYP3A4CYP2C9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101558059-B | Hepatitis c virus inhibitors | BRISTOL MYERS SQUIBB CO | 2014-12-03 | — | — | CN | claimed |
| CN-101558059-A | Hepatitis C virus inhibitors | BRISTOL MYERS SQUIBB CO (US) | 2009-10-14 | — | — | CN | claimed |