Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | EIF4A3 | P38919 | 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 | |
|---|---|---|---|---|
| SCHEMBL27303133 | 0.83 | — | — | |
| SCHEMBL7931545 | 0.80 | TDP1 (0.45) | TDP1MAPK1CYP3A4TRPA1ALDH1A1 | |
| SCHEMBL10347965 | 0.78 | TDP1 (0.39) | TDP1MAPK1CYP3A4TRPA1ALDH1A1 | |
| SCHEMBL9836795 | 0.77 | CYP3A4 (0.42) | TDP1MAPK1CYP3A4TRPA1ALDH1A1 | |
| SCHEMBL8484124 | 0.76 | MAPK1 (0.31) | TDP1MAPK1 | |
| SCHEMBL7021771 | 0.76 | PPOX (0.40) | TDP1MAPK1CYP3A4ALDH1A1HPGD | |
| SCHEMBL28573888 | 0.76 | CYP3A4 (0.41) | TDP1MAPK1CYP3A4TRPA1ALDH1A1 | |
| SCHEMBL8295701 | 0.73 | GABRA1 (0.39) | HPGDEIF4A3 | |
| SCHEMBL8485658 | 0.73 | TDP1 (0.33) | TDP1MAPK1CYP3A4TRPA1ALDH1A1 | |
| SCHEMBL7003782 | 0.73 | ALDH1A1 (0.47) | TDP1MAPK1CYP3A4ALDH1A1HPGD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1058395-A | ARYLAMINOCARBONYL COMPOUNDS | SANDOZ LTD (CH) | 1992-02-05 | — | — | CN | disclosed |
| CN-87105777-A | Heterogeneous ring compound | — | 1988-04-06 | — | — | CN | disclosed |