Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 4/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.42 |
| ▸ | PDE7A | Q13946 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.34 |
| ▸ | PKM | P14618 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.33 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | RECQL | P46063 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17527083 | 0.88 | HSD17B1 (0.39) | CASP1TSHRPDE10AALDH1A1CA12 | |
| SCHEMBL17527031 | 0.85 | PDE7A (0.41) | CASP1TSHRPDE7AALDH1A1TDP1 | |
| SCHEMBL17527048 | 0.81 | PDE7A (0.39) | CASP1TSHRPDE10APDE7AALDH1A1 | |
| SCHEMBL17498279 | 0.79 | ALDH1A1 (0.41) | CASP1TSHRPDE10AALDH1A1TDP1 | |
| SCHEMBL17506791 | 0.76 | SMN1; SMN2 (0.39) | TSHRALDH1A1CA12CA1CA2 | |
| SCHEMBL17506819 | 0.76 | ALDH1A1 (0.48) | CASP1PDE7AALDH1A1CA12CA1 | |
| SCHEMBL17506800 | 0.75 | PDE7A (0.43) | CASP1TSHRPDE10APDE7AALDH1A1 | |
| SCHEMBL7194725 | 0.75 | PDE7A (0.47) | CASP1TSHRPDE10APDE7AALDH1A1 | |
| SCHEMBL17498346 | 0.74 | TSHR (0.44) | CASP1TSHRPDE10AALDH1A1TDP1 | |
| SCHEMBL17527013 | 0.74 | PDE7A (0.49) | CASP1TSHRPDE7AALDH1A1CA12 |
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 |