Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 2/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.44 |
| ▸ | NOS3 | P29474 | 1/20 | 0.37 |
| ▸ | NOS1 | P29475 | 1/20 | 0.37 |
| ▸ | NOS2 | P35228 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.36 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.35 |
| ▸ | NCF1 | P14598 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14403245 | 0.82 | DRD2 (0.39) | SLC6A4SLC6A3ALDH1A1KDM4EL3MBTL1 | |
| SCHEMBL22545205 | 0.80 | NCF1 (0.44) | SLC6A4SLC6A3NOS3NOS1NOS2 | |
| SCHEMBL8453460 | 0.80 | OPRL1 (0.49) | SLC6A4SLC6A3ALDH1A1CYP3A4L3MBTL1 | |
| SCHEMBL8534738 | 0.79 | SLC6A4 (0.44) | SLC6A4SLC6A3NOS3NOS1NOS2 | |
| SCHEMBL613489 | 0.77 | OPRM1 (0.50) | SLC6A4SLC6A3ALDH1A1NPSR1L3MBTL1 | |
| SCHEMBL13324152 | 0.75 | OPRL1 (0.47) | SLC6A4SLC6A3ALDH1A1OPRM1OPRK1 | |
| SCHEMBL744708 | 0.75 | POLB (0.45) | SLC6A4SLC6A3SMN1; SMN2HPGDHTT | |
| SCHEMBL742824 | 0.74 | DRD2 (0.37) | SLC6A4SLC6A3ALDH1A1OPRM1OPRK1 | |
| SCHEMBL2385636 | 0.74 | OPRM1 (0.43) | SLC6A4SLC6A3SMN1; SMN2CYP3A4LMNA | |
| SCHEMBL613410 | 0.74 | DRD2 (0.55) | SLC6A4SLC6A3ALDH1A1MAPTSMN1; SMN2 |
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 3 patents. 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 |
| US-5455273-A | Antiacholesterol agents | KARL THOMAE GMBH (DE) | 1995-10-03 | — | — | US | disclosed |
| EP-0599203-A1 | N,N-disubstituted arylcycloacrylamines, their salts, medicines containing these compounds and their use as well as processes for their preparation | Dr. Karl Thomae GmbH (DE) | 1994-06-01 | — | — | EP | disclosed |