Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.41 |
| ▸ | RECQL | P46063 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 6/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 6/20 | 0.33 |
| ▸ | CA12 | O43570 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | CA7 | P43166 | 2/20 | 0.33 |
| ▸ | CA9 | Q16790 | 2/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.33 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5374279 | 0.80 | TDP1 (0.39) | ALOX15ALDH1A1CYP3A4RECQLTDP1 | |
| SCHEMBL17498278 | 0.79 | CA14 (0.44) | ALOX15ALDH1A1CYP3A4RECQLTDP1 | |
| SCHEMBL17538442 | 0.76 | ALOX15 (0.45) | ALOX15ALDH1A1CYP3A4RECQLTDP1 | |
| SCHEMBL17498295 | 0.74 | ALDH1A1 (0.50) | ALOX15ALDH1A1CYP3A4RECQLTDP1 | |
| SCHEMBL28044333 | 0.74 | CXCR2 (0.45) | ALOX15ALDH1A1CYP3A4RECQLTDP1 | |
| SCHEMBL17498273 | 0.74 | ALOX15 (0.41) | ALOX15ALDH1A1CYP3A4RECQLTDP1 | |
| SCHEMBL17526997 | 0.73 | CYP3A4 (0.54) | ALOX15ALDH1A1CYP3A4RECQLTDP1 | |
| SCHEMBL17498309 | 0.72 | ALDH1A1 (0.42) | ALOX15ALDH1A1CYP3A4RECQLTDP1 | |
| SCHEMBL17506803 | 0.71 | ALOX15 (0.47) | ALOX15ALDH1A1CYP3A4RECQLTDP1 | |
| SCHEMBL1417442 | 0.71 | CXCR2 (0.42) | ALOX15ALDH1A1CYP3A4RECQLTDP1 |
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-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 |