Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 2/20 | 0.42 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | DHODH | Q02127 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 2/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4072325 | 0.86 | OPRM1 (0.52) | OPRM1OPRL1EPHX2EPHX1 | |
| SCHEMBL206079 | 0.83 | OPRM1 (0.54) | OPRM1OPRL1EPHX2EPHX1 | |
| Phenethylamine SCHEMBL206732 | 0.81 | EPHX2 (0.50) | OPRM1OPRL1EPHX2EPHX1 | |
| SCHEMBL250598 | 0.79 | OPRM1 (0.43) | OPRM1OPRL1EPHX2EPHX1SMN1; SMN2 | |
| SCHEMBL207060 | 0.78 | DHODH (0.56) | MEN1KMT2ASMN1; SMN2ALDH1A1HTT | |
| SCHEMBL209001 | 0.78 | OPRM1 (0.43) | OPRM1OPRL1EPHX2EPHX1KMT2A | |
| SCHEMBL2985381 | 0.78 | OPRM1 (0.48) | OPRM1OPRL1EPHX2EPHX1 | |
| SCHEMBL207196 | 0.77 | OPRM1 (0.46) | OPRM1OPRL1EPHX2EPHX1ALDH1A1 | |
| SCHEMBL207557 | 0.76 | LMNA (0.52) | EPHX1MEN1KMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL208045 | 0.76 | OPRM1 (0.43) | OPRM1OPRL1EPHX2EPHX1MEN1 |
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 |