Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11532906 | 0.84 | TDP1 (0.36) | TDP1MAPK1ALDH1A1CYP3A4HPGD | |
| SCHEMBL11535245 | 0.79 | TDP1 (0.34) | TDP1MAPK1ALDH1A1CYP3A4HPGD | |
| SCHEMBL11533408 | 0.78 | CYP3A4 (0.42) | TDP1MAPK1CYP3A4 | |
| SCHEMBL11533392 | 0.73 | MAPK1 (0.34) | TDP1MAPK1 | |
| SCHEMBL11528908 | 0.69 | TDP1 (0.42) | TDP1MAPK1ALDH1A1CYP3A4HPGD | |
| SCHEMBL11528876 | 0.67 | MAPK1 (0.34) | TDP1MAPK1 | |
| SCHEMBL1901940 | 0.66 | CYP3A4 (0.50) | TDP1MAPK1ALDH1A1CYP3A4HPGD | |
| SCHEMBL11082116 | 0.66 | TDP1 (0.36) | TDP1MAPK1ALDH1A1CYP3A4HPGD | |
| SCHEMBL10316767 | 0.65 | CYP3A4 (0.39) | TDP1MAPK1ALDH1A1CYP3A4HPGD | |
| SCHEMBL9859266 | 0.65 | CYP3A4 (0.32) | TDP1ALDH1A1CYP3A4HPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-4140792-A | INSECTICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1979-02-20 | — | — | US | disclosed |