Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 12/20 | 0.70 |
| ▸ | CHRM3 | P20309 | 12/20 | 0.70 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.59 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.59 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | NPY2R | P49146 | 1/20 | 0.52 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.51 |
| ▸ | TACR1 | P25103 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL924276 | 0.88 | OPRM1 (0.77) | CHRM2CHRM3OPRM1SIGMAR1MEN1 | |
| Hydrochloric Acid SCHEMBL10974591 | 0.87 | OPRM1 (0.74) | CHRM2CHRM3OPRM1SIGMAR1MEN1 | |
| SCHEMBL924699 | 0.82 | OPRM1 (0.69) | CHRM2CHRM3OPRM1SIGMAR1MEN1 | |
| SCHEMBL8569135 | 0.79 | SLC6A4 (0.72) | CHRM2CHRM3TACR1 | |
| SCHEMBL18623778 | 0.77 | OPRD1 (0.77) | CHRM3OPRM1SIGMAR1OPRD1 | |
| SCHEMBL8565669 | 0.77 | TACR1 (0.80) | CHRM2CHRM3OPRM1TACR1 | |
| SCHEMBL925917 | 0.76 | OPRM1 (0.86) | CHRM2CHRM3OPRM1SIGMAR1MEN1 | |
| SCHEMBL7487237 | 0.76 | CHRM2 (0.65) | CHRM2CHRM3SIGMAR1MEN1KMT2A | |
| SCHEMBL926325 | 0.76 | OPRM1 (0.69) | CHRM2CHRM3OPRM1SIGMAR1MEN1 | |
| SCHEMBL15920013 | 0.75 | OPRM1 (0.80) | CHRM2CHRM3OPRM1SIGMAR1MEN1 |
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 |