Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.62 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.55 |
| ▸ | DHODH | Q02127 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 3/20 | 0.43 |
| ▸ | HTR2C | P28335 | 3/20 | 0.43 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | CDC42 | P60953 | 1/20 | 0.41 |
| ▸ | RB1 | P06400 | 4/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | CASP6 | P55212 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 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 | |
|---|---|---|---|---|
| SCHEMBL4150690 | 0.94 | CYP2D6 (0.69) | CYP2D6KCNH2DHODHMAPTALOX15 | |
| SCHEMBL4152266 | 0.91 | CYP2D6 (0.73) | CYP2D6KCNH2DHODHMAPTALOX15 | |
| SCHEMBL22135764 | 0.79 | CYP2D6 (0.59) | CYP2D6KCNH2DHODHMAPTKMT2A | |
| SCHEMBL22135737 | 0.79 | CYP2D6 (0.59) | CYP2D6KCNH2DHODHMAPTKMT2A | |
| SCHEMBL4142995 | 0.79 | CYP2D6 (0.73) | CYP2D6KCNH2DHODHMAPTALOX15 | |
| SCHEMBL4142710 | 0.79 | CYP2D6 (0.73) | CYP2D6KCNH2DHODHMAPTALOX15 | |
| SCHEMBL4024328 | 0.77 | CYP2D6 (0.57) | CYP2D6KCNH2DHODHMAPTALOX15 | |
| SCHEMBL4139855 | 0.77 | CYP2D6 (1.00) | CYP2D6KCNH2DHODHMAPTALOX15 | |
| SCHEMBL4150973 | 0.77 | CYP2D6 (0.74) | CYP2D6KCNH2DHODHMAPTALOX15 | |
| Hydrochloric Acid SCHEMBL4137980 | 0.76 | CYP2D6 (0.98) | CYP2D6KCNH2DHODHMAPTALOX15 |
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-1654228-B1 | TETRAHYDROCARBAZOLE DERIVATIVES AND THEIR PHARMACEUTICAL USE | SMITHKLINE BEECHAM CORP (US) | 2008-10-22 | — | — | EP | disclosed |