Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.52 |
| ▸ | HPGD | P15428 | 4/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.52 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | GLA | P06280 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | CASP1 | P29466 | 1/20 | 0.52 |
| ▸ | CASP7 | P55210 | 1/20 | 0.52 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.52 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 1/20 | 0.39 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4722269 | 0.85 | ALDH1A1 (0.73) | ALDH1A1HPGDKDM4EHTTGLA | |
| SCHEMBL4858672 | 0.84 | ALDH1A1 (0.72) | ALDH1A1HPGDKDM4EHTTGLA | |
| SCHEMBL30555073 | 0.81 | KDM4E (0.52) | ALDH1A1HPGDKDM4EHTTGLA | |
| SCHEMBL1218547 | 0.81 | KDM4E (0.52) | ALDH1A1HPGDKDM4EHTTGLA | |
| SCHEMBL21950008 | 0.77 | ALDH1A1 (0.50) | ALDH1A1HPGDKDM4EHTTGLA | |
| SCHEMBL4856080 | 0.72 | ALDH1A1 (0.59) | ALDH1A1HPGDKDM4EHTTGLA | |
| SCHEMBL9540885 | 0.72 | KDM4E (0.47) | ALDH1A1HPGDKDM4EGAAMEN1 | |
| SCHEMBL1813746 | 0.70 | ALDH1A1 (0.72) | ALDH1A1HPGDKDM4EHTTGLA | |
| SCHEMBL1215521 | 0.69 | CDC7 (0.50) | ALDH1A1HPGDKDM4EHTTGLA | |
| SCHEMBL24455354 | 0.69 | RPS6KB1 (0.49) | ALDH1A1HPGDKDM4EHTTGLA |
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 |
|---|---|---|---|---|---|---|---|
| WO-1993013664-A2 | BIHETEROCYCLIC FUNGICIDAL COMPOUNDS | SCHERING AGROCHEMICALS LIMITED (GB) | 1993-07-22 | — | — | WO | disclosed |