Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 6/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.40 |
| ▸ | USP2 | O75604 | 6/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL19083688 | 0.86 | SCN9A (0.47) | CYP2D6CYP3A4USP2CYP2C19CYP1A2 | |
| SCHEMBL21075502 | 0.82 | POLB (0.49) | ALDH1A1POLBMAPTOPRL1DRD2 | |
| SCHEMBL19083727 | 0.77 | OPRL1 (0.46) | SCN9AALDH1A1OPRL1DRD2 | |
| SCHEMBL19427314 | 0.75 | SCN9A (0.50) | CYP2D6CYP3A4USP2CYP2C19CYP1A2 | |
| SCHEMBL19083881 | 0.74 | FAAH (0.47) | ALDH1A1POLBOPRL1DRD2 | |
| SCHEMBL21075511 | 0.73 | SCN9A (0.45) | CYP2D6CYP3A4USP2CYP2C19CYP1A2 | |
| SCHEMBL19075617 | 0.73 | SCN9A (0.45) | CYP2D6CYP3A4USP2CYP2C19CYP1A2 | |
| SCHEMBL19083685 | 0.72 | CYP2D6 (0.52) | CYP2D6CYP3A4USP2CYP2C19CYP1A2 | |
| SCHEMBL19427308 | 0.71 | SCN9A (0.56) | CYP2D6CYP3A4USP2CYP2C19CYP1A2 | |
| SCHEMBL19430890 | 0.71 | SCN9A (0.47) | CYP2D6CYP3A4USP2CYP2C19CYP1A2 |
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-3166939-B1 | THERAPEUTIC COMPOUNDS AND METHODS OF USE THEREOF | GENENTECH INC (US) | 2019-06-05 | — | — | EP | disclosed |