Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.47 |
| ▸ | THRB | P10828 | 2/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 6/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.38 |
| ▸ | GAA | P10253 | 5/20 | 0.38 |
| ▸ | GFER | P55789 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 4/20 | 0.38 |
| ▸ | MAPK13 | O15264 | 3/20 | 0.38 |
| ▸ | MAPK12 | P53778 | 3/20 | 0.38 |
| ▸ | MAPK11 | Q15759 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL17506826 | 0.90 | CYP3A4 (0.51) | ALDH1A1CYP3A4ALOX15TDP1HIF1A | |
| SCHEMBL17506797 | 0.90 | TDP1 (0.47) | ALDH1A1CYP3A4ALOX15TDP1HIF1A | |
| SCHEMBL17538443 | 0.82 | TSHR (0.41) | ALDH1A1CYP3A4ALOX15TDP1HIF1A | |
| SCHEMBL17527049 | 0.81 | RAPGEF4 (0.53) | ALDH1A1CYP3A4ALOX15TDP1HIF1A | |
| SCHEMBL17526997 | 0.79 | CYP3A4 (0.54) | ALDH1A1CYP3A4ALOX15TDP1HIF1A | |
| SCHEMBL17538442 | 0.78 | ALOX15 (0.45) | ALDH1A1CYP3A4ALOX15TDP1HIF1A | |
| SCHEMBL10494943 | 0.78 | MAPT (0.46) | ALDH1A1CYP3A4ALOX15TDP1HIF1A | |
| SCHEMBL10494914 | 0.78 | TDP1 (0.57) | ALDH1A1CYP3A4ALOX15TDP1HIF1A | |
| SCHEMBL565079 | 0.78 | ALOX15 (0.54) | ALDH1A1CYP3A4ALOX15TDP1HIF1A | |
| SCHEMBL17506803 | 0.77 | ALOX15 (0.47) | ALDH1A1CYP3A4ALOX15TDP1HIF1A |
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-2016020110-A1 | OXY-, THIO- AND AZO- BIS-BENZENE TYPE OXIDATION DYE PRECURSORS | HENKEL AG & CO. KGAA (DE) | 2016-02-11 | — | — | WO | claimed |
| WO-2016020110-A1 | OXY-, THIO- AND AZO- BIS-BENZENE TYPE OXIDATION DYE PRECURSORS | HENKEL AG & CO. KGAA (DE) | 2016-02-11 | — | — | WO | disclosed |