Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 8/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | FYN | P06241 | 1/20 | 0.35 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27545135 | 0.91 | CYP3A4 (0.44) | CYP3A4CYP2C9THRBCYP1A2CYP2D6 | |
| SCHEMBL9195741 | 0.82 | CYP3A4 (0.47) | CYP3A4CYP2C9THRBCYP1A2CYP2D6 | |
| SCHEMBL9567574 | 0.81 | CYP3A4 (0.52) | CYP3A4CYP2C9THRBCYP1A2CYP2D6 | |
| SCHEMBL10517012 | 0.81 | CYP3A4 (0.46) | CYP3A4CYP2C9THRBCYP1A2CYP2D6 | |
| SCHEMBL9665341 | 0.81 | CYP3A4 (0.46) | CYP3A4CYP2C9THRBCYP1A2CYP2D6 | |
| SCHEMBL27545132 | 0.79 | CYP3A4 (0.44) | CYP3A4CYP2C9THRBCYP1A2CYP2D6 | |
| SCHEMBL10594681 | 0.76 | CYP3A4 (0.48) | CYP3A4CYP2C9THRBCYP1A2CYP2D6 | |
| SCHEMBL10594041 | 0.76 | CYP3A4 (0.46) | CYP3A4CYP2C9THRBCYP1A2CYP2D6 | |
| SCHEMBL9201220 | 0.75 | CYP3A4 (0.49) | CYP3A4CYP2C9THRBCYP1A2CYP2D6 | |
| SCHEMBL10594716 | 0.74 | CYP3A4 (0.54) | CYP3A4CYP2C9THRBCYP1A2CYP2D6 |
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-0094167-A2 | Azolyl fungicide and plant growth regulators and compositions containing them | FBC LIMITED (GB) | 1983-11-16 | — | — | EP | disclosed |