Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 2/20 | 0.33 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.32 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.31 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.31 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.31 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.31 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL24158290 | 0.89 | HSP90AA1 (0.33) | — | |
| SCHEMBL21187471 | 0.72 | HSD11B1 (0.39) | HSD11B1CYP17A1CYP1A2MAPK13MAPK12 | |
| SCHEMBL21187510 | 0.72 | HSD11B1 (0.36) | HSD11B1CYP17A1CYP1A2NISCHPTPN11 | |
| SCHEMBL21187476 | 0.70 | HSD11B1 (0.43) | HSD11B1CYP17A1CYP1A2NISCHMAPK14 | |
| SCHEMBL21187438 | 0.69 | HSD11B1 (0.42) | HSD11B1CYP17A1CYP1A2NISCHMAPK14 | |
| SCHEMBL21187498 | 0.68 | HSD11B1 (0.39) | HSD11B1CYP17A1CYP1A2MAPK13MAPK12 | |
| SCHEMBL21187487 | 0.65 | TDO2 (0.35) | HSD11B1CYP17A1CYP1A2NISCHMAPK14 | |
| SCHEMBL21187496 | 0.61 | NISCH (0.34) | HSD11B1CYP17A1CYP1A2NISCHMAPK14 | |
| SCHEMBL21187570 | 0.60 | NISCH (0.42) | HSD11B1CYP17A1NISCHMAPK13MAPK12 | |
| SCHEMBL21187571 | 0.58 | HSD11B1 (0.48) | HSD11B1NISCHPTPN11 |
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-3740474-B1 | AGRICULTURAL CHEMICALS | GLOBACHEM NV (BE) | 2022-01-05 | — | — | EP | disclosed |