Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 11/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 7/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 6/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | FPR2 | P25090 | 2/20 | 0.50 |
| ▸ | CSNK1A1 | P48729 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | MTOR | P42345 | 1/20 | 0.50 |
| ▸ | MYLK | Q15746 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 7/20 | 0.49 |
| ▸ | THPO | P40225 | 4/20 | 0.49 |
| ▸ | PMP22 | Q01453 | 4/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 4/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.49 |
| ▸ | APEX1 | P27695 | 1/20 | 0.49 |
| ▸ | BLM | P54132 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9193448 | 0.88 | CYP3A4 (0.51) | CYP3A4CYP1A2CYP2C19CYP2D6CYP2C9 | |
| SCHEMBL2909360 | 0.86 | CYP3A4 (0.68) | CYP3A4CYP1A2CYP2C19CYP2D6CYP2C9 | |
| SCHEMBL2909004 | 0.85 | CYP3A4 (0.60) | CYP3A4CYP1A2CYP2C19CYP2D6CYP2C9 | |
| SCHEMBL8673729 | 0.83 | CYP3A4 (0.70) | CYP3A4CYP1A2CYP2C19CYP2D6CYP2C9 | |
| SCHEMBL2907790 | 0.83 | CYP3A4 (0.49) | CYP3A4CYP1A2CYP2C19CYP2D6CYP2C9 | |
| SCHEMBL2910807 | 0.82 | CYP3A4 (0.51) | CYP3A4CYP1A2CYP2C19CYP2D6CYP2C9 | |
| SCHEMBL2908623 | 0.80 | CYP3A4 (0.47) | CYP3A4CYP1A2CYP2C19CYP2D6CYP2C9 | |
| SCHEMBL2908589 | 0.80 | CYP3A4 (0.55) | CYP3A4CYP1A2CYP2C19CYP2D6CYP2C9 | |
| SCHEMBL2910483 | 0.78 | CYP3A4 (0.62) | CYP3A4CYP1A2CYP2C19CYP2D6CYP2C9 | |
| SCHEMBL2908258 | 0.78 | CYP3A4 (0.56) | CYP3A4CYP1A2CYP2C19CYP2D6CYP2C9 |
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-0956865-B1 | MEDICINES COMPRISING Rho KINASE INHIBITOR | MITSUBISHI PHARMA CORP (JP) | 2007-04-18 | — | — | EP | disclosed |