Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 4/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | HRH1 | P35367 | 1/20 | 0.31 |
| ▸ | GBA1 | P04062 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9435484 | 0.76 | OPRM1 (0.38) | OPRM1HTR2ASLC18A3 | |
| SCHEMBL9435480 | 0.76 | OPRM1 (0.38) | OPRM1HTR2ASLC18A3 | |
| SCHEMBL7106849 | 0.73 | KDM1A (0.40) | KDM1AMAOASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL22966038 | 0.71 | SLC6A4 (0.38) | OPRM1TSHRSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL8072323 | 0.71 | OPRL1 (0.35) | OPRM1KDM1AMAOASIGMAR1 | |
| SCHEMBL10608954 | 0.67 | GAA (0.44) | OPRM1SLC6A2SLC6A4 | |
| SCHEMBL10726987 | 0.65 | SLC6A4 (0.38) | OPRM1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL12265180 | 0.65 | OPRM1 (0.44) | OPRM1HTR2A | |
| SCHEMBL6967188 | 0.65 | OPRM1 (0.50) | OPRM1KDM1A | |
| SCHEMBL7754262 | 0.64 | SIGMAR1 (0.41) | SIGMAR1SLC6A2SLC6A4SLC6A3 |
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-5371088-A | 1-aryl-4-piperazinylcyclohexanecarbonitriles, the preparation and use thereof | BASF AKTIENGESELLSCHAFT (DE) | 1994-12-06 | — | — | US | disclosed |