Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 7/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.46 |
| ▸ | KCNA5 | P22460 | 4/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.46 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | MC4R | P32245 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6577097 | 0.81 | GRIN2B (0.54) | CYP2D6CYP1A2CYP3A4KCNH2CYP2C9 | |
| SCHEMBL21093518 | 0.81 | GRIN2B (0.54) | CYP2D6CYP1A2CYP3A4KCNH2CYP2C9 | |
| SCHEMBL13039134 | 0.81 | CYP2D6 (0.57) | CYP2D6CYP1A2CYP3A4KCNH2CYP2C9 | |
| SCHEMBL2714385 | 0.78 | CYP2D6 (0.54) | CYP2D6CYP1A2CYP3A4KCNH2CYP2C9 | |
| SCHEMBL21093474 | 0.78 | CYP2D6 (0.54) | CYP2D6CYP1A2CYP3A4KCNH2CYP2C9 | |
| SCHEMBL597166 | 0.78 | CYP2D6 (0.54) | CYP2D6CYP1A2CYP3A4KCNH2CYP2C9 | |
| SCHEMBL523547 | 0.78 | CYP2D6 (0.54) | CYP2D6CYP1A2CYP3A4KCNH2CYP2C9 | |
| SCHEMBL21758873 | 0.78 | CYP2D6 (0.54) | CYP2D6CYP1A2CYP3A4KCNH2CYP2C9 | |
| SCHEMBL2712368 | 0.78 | CYP2D6 (0.54) | CYP2D6CYP1A2CYP3A4KCNH2CYP2C9 | |
| SCHEMBL8002190 | 0.78 | CYP2D6 (0.53) | CYP2D6CYP1A2CYP3A4KCNH2CYP2C9 |
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-5130309-A | Cardiovascular disorders | A. H. ROBINS COMPANY, INCORPORATED (US) | 1992-07-14 | — | — | US | disclosed |