Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 10/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | TP53 | P04637 | 4/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.43 |
| ▸ | HTR2A | P28223 | 4/20 | 0.43 |
| ▸ | HTR2C | P28335 | 4/20 | 0.43 |
| ▸ | HTR2B | P41595 | 4/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.43 |
| ▸ | DRD2 | P14416 | 3/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.43 |
| ▸ | HRH1 | P35367 | 3/20 | 0.43 |
| ▸ | DRD3 | P35462 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4778428 | 0.81 | PDF (0.47) | KDM1AMAPK1CYP2D6MAPTTP53 | |
| SCHEMBL11168758 | 0.81 | KDM1A (0.65) | KDM1AMAPK1CYP2D6MAPTTP53 | |
| SCHEMBL4238190 | 0.81 | KDM1A (0.67) | KDM1AMAPK1CYP2D6MAPTTP53 | |
| SCHEMBL4729385 | 0.81 | MAPT (0.65) | KDM1AMAPK1CYP2D6MAPTTP53 | |
| SCHEMBL4780685 | 0.80 | KDM1A (0.50) | KDM1AMAPK1CYP2D6MAPTTP53 | |
| SCHEMBL21436166 | 0.79 | CYP2D6 (0.44) | KDM1AMAPK1CYP2D6MAPTTP53 | |
| SCHEMBL21436165 | 0.79 | PIM1 (0.46) | KDM1AMAPK1CYP2D6MAPTTP53 | |
| SCHEMBL6863955 | 0.78 | CYP2D6 (0.44) | KDM1AMAPK1CYP2D6MAPTTP53 | |
| SCHEMBL4780730 | 0.78 | CYP2D6 (0.45) | KDM1AMAPK1CYP2D6MAPTTP53 | |
| SCHEMBL7585294 | 0.77 | CYP2D6 (0.65) | KDM1AMAPK1CYP2D6MAPTTP53 |
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 |