Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 14/20 | 0.67 |
| ▸ | TACR1 | P25103 | 4/20 | 0.67 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.45 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.39 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8564833 | 0.88 | OPRM1 (0.83) | OPRM1TACR1OPRD1CHRM3SIGMAR1 | |
| SCHEMBL8568687 | 0.85 | OPRM1 (0.67) | OPRM1TACR1OPRD1CHRM3SIGMAR1 | |
| SCHEMBL8568971 | 0.85 | OPRM1 (0.67) | OPRM1TACR1OPRD1CHRM3SIGMAR1 | |
| SCHEMBL8630338 | 0.84 | OPRM1 (0.72) | OPRM1TACR1OPRD1CHRM3SIGMAR1 | |
| SCHEMBL8564719 | 0.83 | OPRM1 (0.69) | OPRM1TACR1OPRD1CHRM3SIGMAR1 | |
| SCHEMBL8564685 | 0.82 | OPRM1 (0.82) | OPRM1TACR1OPRD1CHRM3SIGMAR1 | |
| SCHEMBL8568831 | 0.82 | OPRM1 (0.81) | OPRM1TACR1OPRD1CHRM3SIGMAR1 | |
| SCHEMBL8565491 | 0.82 | OPRM1 (0.67) | OPRM1TACR1OPRD1CHRM3SIGMAR1 | |
| SCHEMBL8570791 | 0.81 | OPRM1 (0.73) | OPRM1TACR1OPRD1CHRM3SIGMAR1 | |
| SCHEMBL8569082 | 0.80 | OPRM1 (0.79) | OPRM1TACR1OPRD1CHRM3SIGMAR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0708101-B1 | Piperidine derivatives, useful as neurokinin receptor antagonists | ADIR (FR) | 1998-12-09 | — | — | EP | disclosed |
| US-5652246-A | NEUROKININ RECEPTOR ANTAGONISTS; NERVOUS SYSTEM DISORDERS | ADIR ET COMPAGNIE (FR) | 1997-07-29 | — | — | US | disclosed |
| EP-0708101-A1 | Novel piperidine derivatives, useful as neurokinin receptor antagonists | ADIR ET COMPAGNIE (FR) | 1996-04-24 | — | — | EP | disclosed |