Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MC4R | P32245 | 1/20 | 0.50 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.48 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.45 |
| ▸ | CHKA | P35790 | 1/20 | 0.45 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CCR3 | P51677 | 2/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL14279639 | 0.88 | MC4R (0.50) | MC4ROPRM1CHKACYP3A4CYP2D6 | |
| SCHEMBL18458358 | 0.85 | OPRM1 (0.56) | MC4ROPRM1SIGMAR1KCNA3LMNA | |
| SCHEMBL14279621 | 0.84 | MC4R (0.59) | MC4ROPRM1SIGMAR1CHKAKCNA3 | |
| SCHEMBL14836350 | 0.84 | OPRM1 (0.55) | MC4ROPRM1SIGMAR1KCNA3LMNA | |
| SCHEMBL5199646 | 0.84 | OPRM1 (0.55) | MC4ROPRM1SIGMAR1KCNA3LMNA | |
| SCHEMBL22441511 | 0.82 | OPRM1 (0.59) | MC4ROPRM1SIGMAR1KCNA3LMNA | |
| SCHEMBL2087707 | 0.82 | OPRM1 (0.59) | MC4ROPRM1SIGMAR1CHKACYP3A4 | |
| SCHEMBL2335642 | 0.77 | OPRM1 (0.60) | OPRM1SIGMAR1POLBCCR3CYP3A4 | |
| SCHEMBL18458363 | 0.76 | OPRM1 (0.52) | MC4ROPRM1SIGMAR1KCNA3LMNA | |
| SCHEMBL3523156 | 0.76 | OPRM1 (0.52) | MC4ROPRM1SIGMAR1KCNA3LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018153545-A1 | PIPERIDINE METHANONE DERIVATIVES HAVING MULTIMODAL ACTIVITY AGAINST PAIN | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 2018-08-30 | — | — | WO | disclosed |