Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 6/20 | 0.61 |
| ▸ | MAPT | P10636 | 6/20 | 0.61 |
| ▸ | DRD2 | P14416 | 5/20 | 0.61 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.61 |
| ▸ | LMNA | P02545 | 5/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.61 |
| ▸ | ADRA2A | P08913 | 4/20 | 0.61 |
| ▸ | ADRA2B | P18089 | 4/20 | 0.61 |
| ▸ | ADRA2C | P18825 | 4/20 | 0.61 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.61 |
| ▸ | HTR2A | P28223 | 4/20 | 0.61 |
| ▸ | HTR2C | P28335 | 4/20 | 0.61 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.61 |
| ▸ | HRH1 | P35367 | 4/20 | 0.61 |
| ▸ | DRD3 | P35462 | 4/20 | 0.61 |
| ▸ | HTR2B | P41595 | 4/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.61 |
| ▸ | HTR1A | P08908 | 4/20 | 0.61 |
| ▸ | TP53 | P04637 | 4/20 | 0.61 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL3441267 | 0.99 | CYP2D6 (0.60) | CYP2D6MAPTDRD2CYP2C19LMNA | |
| SCHEMBL6637375 | 0.77 | LMNA (0.74) | CYP2D6MAPTDRD2CYP2C19LMNA | |
| SCHEMBL30030635 | 0.76 | KDM1A (0.79) | CYP2D6MAPTDRD2CYP2C19LMNA | |
| SCHEMBL18752072 | 0.76 | KDM1A (0.79) | CYP2D6MAPTDRD2CYP2C19LMNA | |
| Perphenazine SCHEMBL29385591 | 0.76 | MAPT (1.00) | CYP2D6MAPTDRD2CYP2C19LMNA | |
| Perphenazine SCHEMBL29461866 | 0.76 | MAPT (1.00) | CYP2D6MAPTDRD2CYP2C19LMNA | |
| Perphenazine SCHEMBL42125 | 0.76 | MAPT (1.00) | CYP2D6MAPTDRD2CYP2C19LMNA | |
| Perphenazine SCHEMBL8762197 | 0.76 | MAPT (1.00) | CYP2D6MAPTDRD2CYP2C19LMNA | |
| SCHEMBL5082482 | 0.76 | CYP2D6 (0.59) | CYP2D6MAPTDRD2CYP2C19LMNA | |
| SCHEMBL6045312 | 0.76 | PIM1 (0.56) | CYP2D6MAPTDRD2CYP2C19LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1956906-A2 | METHODS, COMPOSITIONS, AND KITS FOR THE TREATMENT OF MEDICAL CONDITIONS | CombinatoRx, Incorporated (US) | 2008-08-20 | — | — | EP | disclosed |
| WO-2007056457-A2 | METHODS, COMPOSITIONS, AND KITS FOR THE TREATMENT OF MEDICAL CONDITIONS | COMBINATORX, INCORPORATED (US) | 2007-05-18 | — | — | WO | disclosed |