Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 4/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.43 |
| ▸ | TSHR | P16473 | 4/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.37 |
| ▸ | THRB | P10828 | 3/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 6/20 | 0.36 |
| ▸ | GLA | P06280 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL17498272 | 0.86 | PDE10A (0.48) | CASP1CYP3A4TSHRMAPK1ALDH1A1 | |
| SCHEMBL17498288 | 0.85 | CYP3A4 (0.57) | CASP1CYP3A4TSHRMAPK1ALDH1A1 | |
| SCHEMBL3158954 | 0.83 | MAPT (0.43) | CASP1CYP3A4TSHRMAPK1ALDH1A1 | |
| SCHEMBL17498295 | 0.81 | ALDH1A1 (0.50) | CASP1CYP3A4TSHRMAPK1ALDH1A1 | |
| SCHEMBL17498284 | 0.78 | CASP1 (0.55) | CASP1CYP3A4TSHRALDH1A1TDP1 | |
| SCHEMBL17506802 | 0.77 | RAPGEF4 (0.56) | CASP1CYP3A4TSHRMAPK1ALDH1A1 | |
| SCHEMBL17498290 | 0.77 | PDE10A (0.50) | CASP1CYP3A4TSHRMAPK1ALDH1A1 | |
| SCHEMBL17506815 | 0.76 | TDP1 (0.47) | CASP1CYP3A4TSHRMAPK1ALDH1A1 | |
| SCHEMBL17498289 | 0.75 | PDE10A (0.53) | CASP1CYP3A4TSHRMAPK1ALDH1A1 | |
| SCHEMBL17538440 | 0.74 | CYP3A4 (0.44) | CASP1CYP3A4TSHRMAPK1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016020111-A1 | NOVEL OXIDATION DYE INTERMEDIATES OF THE TYPE OF OXY-, THIO-, AND AZA-BIS-BENZENES | HENKEL AG & CO. KGAA (DE) | 2016-02-11 | — | — | WO | disclosed |
| WO-2016020111-A1 | NOVEL OXIDATION DYE INTERMEDIATES OF THE TYPE OF OXY-, THIO-, AND AZA-BIS-BENZENES | HENKEL AG & CO. KGAA (DE) | 2016-02-11 | — | — | WO | disclosed |