Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH5 | P11766 | 14/20 | 1.00 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | CYP4Z1 | Q86W10 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.48 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL17630071 | 0.92 | ADH5 (1.00) | ADH5CYP3A4BAZ2BHTTCYP4Z1 | |
| SCHEMBL17629973 | 0.85 | ADH5 (1.00) | ADH5CYP3A4BAZ2BHTTCYP4Z1 | |
| SCHEMBL17643516 | 0.85 | ADH5 (0.73) | ADH5CYP3A4BAZ2BHTTCYP4Z1 | |
| SCHEMBL17630095 | 0.85 | ADH5 (1.00) | ADH5CYP3A4BAZ2BHTTCYP4Z1 | |
| SCHEMBL17629943 | 0.84 | ADH5 (0.72) | ADH5CYP3A4BAZ2BHTTCYP4Z1 | |
| SCHEMBL17630068 | 0.82 | ADH5 (1.00) | ADH5CYP3A4BAZ2BHTTCYP4Z1 | |
| SCHEMBL62049 | 0.80 | ADH5 (0.90) | ADH5CYP3A4BAZ2BHTTCYP4Z1 | |
| SCHEMBL17630105 | 0.80 | ADH5 (1.00) | ADH5CYP3A4BAZ2BHTTNPC1 | |
| SCHEMBL17679919 | 0.79 | ADH5 (0.65) | ADH5CYP3A4BAZ2BHTTCYP4Z1 | |
| Hydrochloric Acid SCHEMBL6152702 | 0.79 | ADH5 (0.87) | ADH5CYP3A4BAZ2BHTTCYP4Z1 |
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-2016046782-A1 | IMIDAZOLE BIARYL COMPOUNDS AS S-NITROSOGLUTATHIONE REDUCTASE INHIBITORS | GLENMARK PHARMACEUTICALS S.A. (CH) | 2016-03-31 | — | — | WO | disclosed |