Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.56 |
| ▸ | RECQL | P46063 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | THRB | P10828 | 1/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.56 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | MAPK14 | Q16539 | 4/20 | 0.40 |
| ▸ | MAPK13 | O15264 | 3/20 | 0.40 |
| ▸ | MAPK12 | P53778 | 3/20 | 0.40 |
| ▸ | MAPK11 | Q15759 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 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 | |
|---|---|---|---|---|
| SCHEMBL17526997 | 0.89 | CYP3A4 (0.54) | TDP1CYP3A4RECQLALDH1A1THRB | |
| SCHEMBL17506809 | 0.86 | TDP1 (0.49) | TDP1CYP3A4RECQLALDH1A1THRB | |
| SCHEMBL17498284 | 0.83 | CASP1 (0.55) | TDP1CYP3A4RECQLALDH1A1THRB | |
| SCHEMBL17506803 | 0.81 | ALOX15 (0.47) | TDP1CYP3A4RECQLALDH1A1THRB | |
| SCHEMBL17498295 | 0.79 | ALDH1A1 (0.50) | TDP1CYP3A4RECQLALDH1A1THRB | |
| SCHEMBL17508260 | 0.78 | RAPGEF4 (0.57) | TDP1CYP3A4RECQLALDH1A1THRB | |
| SCHEMBL17508194 | 0.78 | TDP1 (0.54) | TDP1CYP3A4RECQLALDH1A1THRB | |
| SCHEMBL17498278 | 0.78 | CA14 (0.44) | TDP1CYP3A4RECQLALDH1A1THRB | |
| SCHEMBL17506813 | 0.77 | CYP3A4 (0.55) | TDP1CYP3A4RECQLALDH1A1THRB | |
| SCHEMBL6029639 | 0.76 | TDP1 (0.64) | TDP1CYP3A4RECQLALDH1A1THRB |
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-2016020110-A1 | OXY-, THIO- AND AZO- BIS-BENZENE TYPE OXIDATION DYE PRECURSORS | HENKEL AG & CO. KGAA (DE) | 2016-02-11 | — | — | WO | disclosed |