Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 6/20 | 0.44 |
| ▸ | OPRL1 | P41146 | 6/20 | 0.44 |
| ▸ | CCR8 | P51685 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 2/20 | 0.36 |
| ▸ | CNR1 | P21554 | 2/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | LTA4H | P09960 | 1/20 | 0.35 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4074080 | 0.85 | OPRM1 (0.51) | OPRM1OPRL1NPC1RAB9A | |
| SCHEMBL4074077 | 0.82 | OPRM1 (0.51) | OPRM1OPRL1NPC1RAB9A | |
| SCHEMBL205762 | 0.81 | OPRM1 (0.46) | OPRM1OPRL1MEN1KMT2ARAB9A | |
| SCHEMBL206843 | 0.80 | CHRM4 (0.41) | OPRM1OPRL1MEN1KMT2ACNR2 | |
| SCHEMBL250548 | 0.80 | OPRM1 (0.48) | OPRM1OPRL1 | |
| (+)-Tranylcypromine SCHEMBL250154 | 0.80 | OPRM1 (0.45) | OPRM1OPRL1MAOB | |
| SCHEMBL251239 | 0.79 | OPRM1 (0.44) | OPRM1OPRL1NPC1 | |
| SCHEMBL251283 | 0.79 | OPRM1 (0.44) | OPRM1OPRL1NPC1RAB9A | |
| SCHEMBL250470 | 0.79 | OPRM1 (0.46) | OPRM1OPRL1NPC1KMT2ARAB9A | |
| SCHEMBL249111 | 0.79 | OPRM1 (0.46) | OPRM1OPRL1NPC1RAB9A |
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-8088763-B2 | e.g. N-[1-(2,6-dichloro-benzyl)-pyrrolidin-3-yl]-N'-[4-dimethylamino-4-(4-methyl-benzyl)-cyclohexyl]-succinamide; noradrenaline and serotonin reuptake ihibitor; opioid ORL-1 receptor ligand; analgesic, antidepressant, anxiolytic agent, neurodegenerative diseases | GRUENENTHAL GMBH (DE) | 2012-01-03 | — | — | US | disclosed |