Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 2/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 4/20 | 0.38 |
| ▸ | OPRL1 | P41146 | 4/20 | 0.38 |
| ▸ | NOS3 | P29474 | 1/20 | 0.37 |
| ▸ | NOS1 | P29475 | 1/20 | 0.37 |
| ▸ | NOS2 | P35228 | 1/20 | 0.37 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
| ▸ | HTR1D | P28221 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.32 |
| ▸ | CYP26B1 | Q9NR63 | 1/20 | 0.32 |
| ▸ | LTA4H | P09960 | 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 | |
|---|---|---|---|---|
| SCHEMBL14403245 | 0.82 | DRD2 (0.39) | SLC6A4SLC6A3HRH3OPRM1OPRK1 | |
| SCHEMBL8453460 | 0.80 | OPRL1 (0.49) | SLC6A4SLC6A3OPRM1OPRK1OPRL1 | |
| SCHEMBL615022 | 0.80 | OPRL1 (0.47) | SLC6A4SLC6A3OPRM1OPRK1OPRL1 | |
| SCHEMBL744179 | 0.79 | SLC6A4 (0.34) | SLC6A4SLC6A3HRH3NOS3NOS1 | |
| SCHEMBL30406901 | 0.79 | SLC6A4 (0.34) | SLC6A4SLC6A3HRH3NOS3NOS1 | |
| SCHEMBL8585142 | 0.79 | SLC6A4 (0.44) | SLC6A4SLC6A3OPRM1OPRK1OPRL1 | |
| SCHEMBL613489 | 0.77 | OPRM1 (0.50) | SLC6A4SLC6A3OPRM1OPRK1OPRL1 | |
| SCHEMBL8780434 | 0.75 | HRH3 (0.41) | HRH3OPRM1OPRK1OPRL1NOS3 | |
| SCHEMBL13324152 | 0.75 | OPRL1 (0.47) | SLC6A4SLC6A3HRH3OPRM1OPRK1 | |
| SCHEMBL613410 | 0.74 | DRD2 (0.55) | SLC6A4SLC6A3OPRM1OPRK1OPRL1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0757669-B1 | O-ACYL-4-PHENYL-CYCLOHEXANOLS, THEIR SALTS, MEDICAMENTS CONTAINING SUCH COMPOUNDS AND THEIR USE, AS WELL AS A METHOD OF PREPARING THEM | BOEHRINGER INGELHEIM PHARMA (DE) | 1998-11-18 | — | — | EP | disclosed |