Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | Q9HBH1 | 2/20 | 0.47 | |
| ▸ | KDM1A | O60341 | 4/20 | 0.46 |
| ▸ | PIM1 | P11309 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.44 |
| ▸ | MAPT | P10636 | 5/20 | 0.44 |
| ▸ | HTR1A | P08908 | 4/20 | 0.44 |
| ▸ | DRD2 | P14416 | 4/20 | 0.44 |
| ▸ | LMNA | P02545 | 4/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.44 |
| ▸ | SLC22A1 | O15245 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 3/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.44 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.44 |
| ▸ | CHRM5 | P08912 | 3/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.44 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.44 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL4780685 | 0.96 | KDM1A (0.50) | PDFKDM1APIM1CYP2D6CYP2C19 | |
| SCHEMBL4780730 | 0.91 | CYP2D6 (0.45) | PDFKDM1ACYP2D6CYP2C19CYP1A2 | |
| SCHEMBL21436165 | 0.88 | PIM1 (0.46) | KDM1APIM1CYP2D6CYP2C19CYP1A2 | |
| SCHEMBL6863955 | 0.86 | CYP2D6 (0.44) | KDM1APIM1CYP2D6CYP2C19CYP1A2 | |
| SCHEMBL21436166 | 0.85 | CYP2D6 (0.44) | KDM1APIM1CYP2D6CYP2C19CYP1A2 | |
| SCHEMBL7585294 | 0.85 | CYP2D6 (0.65) | KDM1ACYP2D6CYP2C19CYP1A2MAPT | |
| SCHEMBL4238190 | 0.82 | KDM1A (0.67) | KDM1ACYP2D6CYP2C19CYP1A2MAPT | |
| SCHEMBL4783514 | 0.81 | KDM1A (0.45) | KDM1ACYP2D6CYP2C19CYP1A2MAPT | |
| SCHEMBL718878 | 0.79 | PIM1 (0.69) | PDFKDM1APIM1CYP2D6CYP2C19 | |
| SCHEMBL342329 | 0.78 | PIM1 (0.67) | PDFKDM1APIM1CYP2D6CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008021745-A2 | HEPATITIS C VIRUS ENTRY INHIBITORS | ITHERX PHARMACEUTICALS, INC. (US) | 2008-02-21 | — | — | WO | disclosed |