Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNLIP | P16233 | 1/20 | 0.46 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.46 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.46 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.39 |
| ▸ | GPR27 | Q9NS67 | 1/20 | 0.39 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.39 |
| ▸ | DHODH | Q02127 | 2/20 | 0.39 |
| ▸ | AR | P10275 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.38 |
| ▸ | XDH | P47989 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL22407029 | 0.86 | PNLIP (0.46) | PNLIPCYP11B1CYP11B2AVPR2GPR27 | |
| SCHEMBL22439731 | 0.81 | AKR1C2 (0.48) | DHODHPPARAAKR1C2AKR1C1SCN9A | |
| SCHEMBL22439725 | 0.81 | AR (0.52) | CYP11B1CYP11B2EGLN1ARCYP3A4 | |
| SCHEMBL22439738 | 0.79 | XDH (0.41) | PNLIPPPARAAKR1C2XDHSLC22A12 | |
| SCHEMBL22439721 | 0.79 | CYP11B1 (0.48) | PNLIPCYP11B1CYP11B2SCN9AXDH | |
| SCHEMBL22406867 | 0.78 | TSHR (0.46) | PNLIPCYP11B1CYP11B2MAPTPPARA | |
| SCHEMBL29377336 | 0.78 | TSHR (0.46) | PNLIPCYP11B1CYP11B2MAPTPPARA | |
| SCHEMBL22439723 | 0.75 | ALDH1A1 (0.46) | PNLIPPPARAXDHSLC22A12PPARG | |
| SCHEMBL20325608 | 0.73 | PPARG (0.43) | MEN1CYP1A2CYP3A4CYP2D6MAPT | |
| SCHEMBL22979516 | 0.73 | TSHR (0.52) | AVPR2GPR27DHODHCYP2C19AKR1C2 |
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-3712135-A1 | AZOLE DERIVATIVE, INTERMEDIATE COMPOUND, METHOD FOR PRODUCING AZOLE DERIVATIVE, AGENT FOR AGRICULTURAL AND HORTICULTURAL USE, AND MATERIAL PROTECTION AGENT FOR INDUSTRIAL USE | Kureha Corporation (JP) | 2020-09-23 | — | — | EP | disclosed |