Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | KCNN4 | O15554 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | SCN1A | P35498 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.39 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 2/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 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 | |
|---|---|---|---|---|
| SCHEMBL10880212 | 0.85 | CYP1A2 (0.46) | CYP1A2CYP2C19CYP2C9ALDH1A1TSHR | |
| SCHEMBL1431990 | 0.78 | CYP2C9 (0.43) | CYP1A2CYP2C19CYP2C9CYP3A4MAPK1 | |
| SCHEMBL3889410 | 0.74 | KCNN4 (0.44) | CYP1A2CYP2C19CYP2C9CYP3A4ALDH1A1 | |
| SCHEMBL8793845 | 0.74 | ALDH1A1 (0.44) | CYP1A2CYP2C19CYP2C9CYP3A4MAPK1 | |
| SCHEMBL8793851 | 0.74 | ALDH1A1 (0.44) | CYP1A2CYP2C19CYP2C9CYP3A4MAPK1 | |
| SCHEMBL2208136 | 0.72 | CYP1A2 (0.54) | CYP1A2CYP2C19CYP2C9ALDH1A1TSHR | |
| SCHEMBL10657920 | 0.71 | CYP1A2 (0.44) | CYP1A2CYP2C19CYP2C9CYP3A4MAPK1 | |
| SCHEMBL8187278 | 0.71 | KCNN4 (0.58) | CYP1A2CYP2C19CYP2C9CYP3A4MAPK1 | |
| SCHEMBL3360360 | 0.70 | MAPT (0.54) | CYP2C19CYP3A4MAPK1ALDH1A1TSHR | |
| SCHEMBL3085916 | 0.70 | ALDH1A1 (0.38) | CYP1A2CYP2C19CYP2C9CYP3A4MAPK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0118833-B1 | SUBSTITUTED DIAMIDES OF PHENYLHYDROXY-THIOMALONIC ACIDS, PROCESS FOR THEIR PREPARATION AND THEIR USE AS PESTICIDES | BAYER AG (DE) | 1986-04-02 | — | — | EP | claimed |
| EP-0118833-A1 | Substituted diamides of phenylhydroxy-thiomalonic acids, process for their preparation and their use as pesticides | BAYER AG (DE) | 1984-09-19 | — | — | EP | disclosed |
| EP-0118833-A1 | Substituted diamides of phenylhydroxy-thiomalonic acids, process for their preparation and their use as pesticides | BAYER AG (DE) | 1984-09-19 | — | — | EP | disclosed |