Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH5 | P11766 | 11/20 | 0.60 |
| ▸ | PDE2A | O00408 | 1/20 | 0.50 |
| ▸ | PDE1A | P54750 | 1/20 | 0.50 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.50 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.50 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.50 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | ADH1B | P00325 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL17643381 | 0.84 | PDE2A (0.50) | ADH5PDE2APDE1APDE1BPDE3B | |
| SCHEMBL17630206 | 0.84 | ADH5 (0.60) | ADH5PDE2APDE1APDE1BPDE3B | |
| SCHEMBL17643377 | 0.84 | ADH5 (0.60) | ADH5PDE2APDE1APDE1BPDE3B | |
| SCHEMBL17630034 | 0.83 | ADH5 (0.46) | ADH5CYP19A1ALOX15CYP1A2CYP3A4 | |
| SCHEMBL17629992 | 0.81 | MEN1 (0.64) | ADH5PDE2APDE1APDE1BPDE3B | |
| SCHEMBL17630188 | 0.81 | ADH5 (0.59) | ADH5PDE2APDE1APDE1BPDE3B | |
| SCHEMBL17672965 | 0.81 | MAPK1 (0.42) | ADH5PDE2APDE1APDE1BPDE3B | |
| SCHEMBL1009532 | 0.80 | LMNA (0.58) | ADH5CYP19A1ALOX15MEN1TSHR | |
| SCHEMBL17630180 | 0.79 | ADH5 (0.64) | ADH5PDE2APDE1APDE1BPDE3B | |
| SCHEMBL17629932 | 0.79 | ADH5 (0.60) | ADH5PDE2APDE1APDE1BPDE3B |
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 |