Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 7/20 | 0.38 |
| ▸ | SLC18A3 | Q16572 | 2/20 | 0.38 |
| ▸ | SLC6A9 | P48067 | 9/20 | 0.37 |
| ▸ | OPRL1 | P41146 | 5/20 | 0.37 |
| ▸ | SLC6A5 | Q9Y345 | 4/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9435480 | 1.00 | OPRM1 (0.38) | OPRM1SLC18A3SLC6A9OPRL1SLC6A5 | |
| SCHEMBL15653158 | 0.77 | SLC18A3 (0.46) | OPRM1SLC18A3SLC6A9OPRL1SLC6A5 | |
| SCHEMBL9435660 | 0.76 | SMN1; SMN2 (0.44) | OPRM1KMT2ASMN1; SMN2HTR2A | |
| SCHEMBL9435666 | 0.76 | OPRM1 (0.40) | OPRM1SLC18A3HTR2A | |
| SCHEMBL9435661 | 0.73 | MEN1 (0.32) | OPRM1KMT2A | |
| SCHEMBL9435475 | 0.71 | CYP2D6 (0.49) | OPRM1OPRL1HPGDKMT2ASMN1; SMN2 | |
| SCHEMBL6963361 | 0.71 | CYP2D6 (0.49) | OPRM1OPRL1HPGDKMT2ASMN1; SMN2 | |
| SCHEMBL7106849 | 0.71 | KDM1A (0.40) | HPGDKMT2A | |
| SCHEMBL20066224 | 0.70 | KDM1A (0.48) | OPRM1SLC18A3OPRL1HPGDKMT2A | |
| SCHEMBL22966038 | 0.70 | SLC6A4 (0.38) | OPRM1 |
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 |