Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 6/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.36 |
| ▸ | KCNA5 | P22460 | 4/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.33 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.33 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20536090 | 0.76 | CYP2D6 (0.54) | CYP2D6KCNH2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL3265533 | 0.76 | DRD1 (0.44) | CYP2D6KCNH2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL4392254 | 0.73 | CYP2D6 (0.45) | CYP2D6KCNH2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL10527232 | 0.69 | MEN1 (0.59) | CYP2D6KCNH2CYP3A4MEN1KMT2A | |
| SCHEMBL6184552 | 0.69 | CYP2D6 (0.42) | CYP2D6KCNH2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8480869 | 0.67 | MAPK1 (0.45) | CYP2D6KCNH2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL17513224 | 0.66 | CYP2D6 (0.39) | CYP2D6KCNH2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL5221988 | 0.66 | CHRM2 (0.50) | CYP2D6CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL7209211 | 0.65 | L3MBTL1 (0.46) | CYP3A4CYP2C19ALDH1A1MEN1KMT2A | |
| SCHEMBL1845086 | 0.59 | KMT2A (0.46) | CYP2D6KCNH2CYP1A2CYP3A4CYP2C9 |
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-4139534-A | Process for the preparation of 14-hydroxymorphinan derivatives | BRISTOL-MYERS COMPANY (US) | 1979-02-13 | — | — | US | disclosed |