Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 4/20 | 0.42 |
| ▸ | CYP2J2 | P51589 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.40 |
| ▸ | DRD2 | P14416 | 2/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | GHSR | Q92847 | 2/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.40 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.40 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL13785557 | 0.84 | DRD2 (0.47) | OPRM1CYP2J2CYP3A4CYP2C9CYP2B6 | |
| SCHEMBL13601296 | 0.84 | OPRM1 (0.44) | OPRM1CYP2J2CYP3A4CYP2C9CYP2B6 | |
| SCHEMBL13785556 | 0.82 | CYP2J2 (0.51) | OPRM1CYP2J2CYP3A4CYP2C9CYP2B6 | |
| SCHEMBL14518960 | 0.81 | KCNH2 (0.44) | OPRM1CYP2J2CHRM1DRD2ADRA2B | |
| SCHEMBL13601289 | 0.81 | OPRM1 (0.42) | OPRM1CYP2J2CHRM1DRD2ADRA2B | |
| SCHEMBL13785561 | 0.77 | CYP2J2 (0.49) | OPRM1CYP2J2CYP3A4CYP2C9CYP2B6 | |
| SCHEMBL12052721 | 0.77 | KCNH2 (0.44) | OPRM1CYP2J2CYP3A4CYP2C9CYP2B6 | |
| SCHEMBL5099271 | 0.76 | CHRM3 (0.57) | OPRM1CYP2J2CYP3A4CYP2C9CYP2B6 | |
| SCHEMBL5095693 | 0.76 | CHRM3 (0.57) | OPRM1CYP2J2CYP3A4CYP2C9CYP2B6 | |
| SCHEMBL5109615 | 0.76 | CHRM3 (0.57) | OPRM1CYP2J2CYP3A4CYP2C9CYP2B6 |
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-7208515-B2 | Diphenylmethyl compounds useful as muscarinic receptor antagonists | THERAVANCE, INC. (US) | 2007-04-24 | — | — | US | disclosed |