Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 2/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.37 |
| ▸ | MMP3 | P08254 | 1/20 | 0.37 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.36 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.36 |
| ▸ | PTGES | O14684 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL17630196 | 0.81 | GRIA1 (0.45) | TBXA2R | |
| SCHEMBL17630080 | 0.80 | PDE2A (0.46) | L3MBTL1 | |
| SCHEMBL17629919 | 0.79 | KDM1A (0.37) | CNR1 | |
| SCHEMBL17629879 | 0.79 | KMT2A (0.48) | CYP2D6CYP2C9CYP2C19KMT2ATBXA2R | |
| SCHEMBL17629922 | 0.75 | KDM1A (0.41) | KMT2AMMP2MMP3 | |
| SCHEMBL17630064 | 0.74 | PDE2A (0.46) | — | |
| SCHEMBL17630007 | 0.73 | HRH2 (0.36) | — | |
| SCHEMBL17630076 | 0.72 | HRH2 (0.35) | L3MBTL1 | |
| SCHEMBL17629872 | 0.71 | HSD17B10 (0.44) | CYP2D6CYP2C9CYP2C19KMT2AMMP2 | |
| SCHEMBL17672870 | 0.70 | CYP2D6 (0.39) | CYP2D6CYP2C9CYP2C19KMT2AMTNR1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016046782-A1 | IMIDAZOLE BIARYL COMPOUNDS AS S-NITROSOGLUTATHIONE REDUCTASE INHIBITORS | GLENMARK PHARMACEUTICALS S.A. (CH) | 2016-03-31 | — | — | WO | disclosed |
| WO-2016046782-A1 | IMIDAZOLE BIARYL COMPOUNDS AS S-NITROSOGLUTATHIONE REDUCTASE INHIBITORS | GLENMARK PHARMACEUTICALS S.A. (CH) | 2016-03-31 | — | — | WO | disclosed |