Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 2/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | HTR3A | P46098 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | GHSR | Q92847 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | AURKA | O14965 | 1/20 | 0.38 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.38 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 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 | |
|---|---|---|---|---|
| SCHEMBL7378213 | 0.84 | CYP3A4 (0.41) | CHRM1LMNADRD3OPRK1HTR1A | |
| SCHEMBL17375354 | 0.78 | LMNA (0.42) | CHRM1LMNADRD3OPRK1HTR1A | |
| SCHEMBL7943725 | 0.78 | LMNA (0.42) | CHRM1LMNADRD3OPRK1HTR1A | |
| SCHEMBL7951246 | 0.78 | LMNA (0.42) | CHRM1LMNADRD3OPRK1HTR1A | |
| SCHEMBL7311280 | 0.77 | CHRM1 (0.51) | CHRM1LMNADRD3OPRK1HTR1A | |
| SCHEMBL7950480 | 0.76 | LMNA (0.43) | CHRM1LMNADRD3OPRK1HTR1A | |
| SCHEMBL11827197 | 0.76 | CHRM1 (0.44) | CHRM1LMNADRD3OPRK1HTR1A | |
| SCHEMBL17375340 | 0.76 | LMNA (0.42) | CHRM1LMNADRD3OPRK1HTR1A | |
| SCHEMBL11610206 | 0.75 | CHRM1 (0.51) | CHRM1LMNADRD3OPRK1HTR1A | |
| SCHEMBL11826517 | 0.75 | CHRM1 (0.47) | CHRM1LMNADRD3OPRK1HTR1A |
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-6174881-B1 | USED AS ANXIOLYTIC AND/OR ANTICONVULSANT AND/OR MUSCLE RELAXANT AGENTS; SEDATIVES OR HYPNOSIS; WATER-SOLUBLE AMINE SALTS; FAST-ACTING | HOFFMAN-LA ROCHE INC. | 2001-01-16 | — | — | US | disclosed |