Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 8/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.37 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | FYN | P06241 | 1/20 | 0.36 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9522169 | 1.00 | CYP3A4 (0.45) | CYP3A4THRBHSP90AA1NPSR1CYP2C9 | |
| SCHEMBL9303287 | 0.84 | CYP3A4 (0.57) | CYP3A4THRBHSP90AA1CYP2C9CYP1A2 | |
| SCHEMBL9522057 | 0.84 | CYP3A4 (0.57) | CYP3A4THRBHSP90AA1CYP2C9CYP1A2 | |
| SCHEMBL9303282 | 0.84 | CYP3A4 (0.57) | CYP3A4THRBHSP90AA1CYP2C9CYP1A2 | |
| SCHEMBL9005028 | 0.82 | CYP3A4 (0.46) | CYP3A4THRBHSP90AA1NPSR1CYP2C9 | |
| SCHEMBL8813231 | 0.82 | CYP3A4 (0.46) | CYP3A4THRBHSP90AA1NPSR1CYP2C9 | |
| SCHEMBL8813224 | 0.82 | CYP3A4 (0.46) | CYP3A4THRBHSP90AA1NPSR1CYP2C9 | |
| SCHEMBL10594371 | 0.80 | CYP3A4 (0.46) | CYP3A4THRBHSP90AA1NPSR1CYP2C9 | |
| SCHEMBL9199001 | 0.79 | CYP3A4 (0.44) | CYP3A4THRBHSP90AA1NPSR1CYP2C9 | |
| SCHEMBL9736709 | 0.79 | CYP3A4 (0.44) | CYP3A4THRBHSP90AA1NPSR1CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0332387-B1 | Triazole derivatives, their preparation and their use as fungicides | SANKYO CO (JP) | 1993-11-24 | — | — | EP | disclosed |
| EP-0332387-A1 | Triazole derivatives, their preparation and their use as fungicides | Sankyo Company Limited (JP) | 1989-09-13 | — | — | EP | disclosed |