Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 4/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.42 |
| ▸ | NUDT1 | P36639 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | G6PD | P11413 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | CYP17A1 | P05093 | 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 | |
|---|---|---|---|---|
| SCHEMBL14896616 | 0.90 | CYP2C19 (0.49) | CYP2C19CYP1A2NUDT1CYP2C9RECQL | |
| SCHEMBL30117099 | 0.87 | NUDT1 (0.39) | CYP2C19CYP1A2NUDT1CYP2C9RECQL | |
| SCHEMBL26099659 | 0.87 | NUDT1 (0.39) | CYP2C19CYP1A2NUDT1CYP2C9RECQL | |
| SCHEMBL29072711 | 0.83 | PDE2A (0.42) | CYP2C19CYP1A2NUDT1CYP2C9RECQL | |
| Hydrochloric Acid SCHEMBL30117143 | 0.83 | CYP2C19 (0.38) | CYP2C19CYP1A2NUDT1CYP2C9RECQL | |
| SCHEMBL30117131 | 0.83 | PDE2A (0.42) | CYP2C19CYP1A2NUDT1CYP2C9RECQL | |
| Hydrochloric Acid SCHEMBL29072877 | 0.83 | NUDT1 (0.38) | CYP2C19CYP1A2NUDT1CYP2C9RECQL | |
| SCHEMBL30229616 | 0.82 | L3MBTL1 (0.40) | CYP2C19CYP1A2NUDT1CYP2C9RECQL | |
| SCHEMBL29072680 | 0.82 | CYP2C19 (0.40) | CYP2C19CYP1A2NUDT1CYP2C9RECQL | |
| SCHEMBL30229766 | 0.82 | CYP2C19 (0.40) | CYP2C19CYP1A2NUDT1CYP2C9RECQL |
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-2195302-B1 | INSECTICIDAL SUBSTITUTED AZINYL DERIVATIVES | DOW AGROSCIENCES LLC (US) | 2015-02-18 | — | — | EP | disclosed |