Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 8/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.61 |
| ▸ | TSHR | P16473 | 5/20 | 0.61 |
| ▸ | CASP1 | P29466 | 2/20 | 0.61 |
| ▸ | THRB | P10828 | 2/20 | 0.61 |
| ▸ | HPGD | P15428 | 2/20 | 0.61 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.61 |
| ▸ | RECQL | P46063 | 1/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | CA6 | P23280 | 1/20 | 0.41 |
| ▸ | CA5A | P35218 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29437149 | 0.88 | — | — | |
| SCHEMBL33731 | 0.88 | — | — | |
| Hydrochloric Acid SCHEMBL28886798 | 0.85 | CYP3A4 (0.71) | CYP3A4ALDH1A1TSHRCASP1THRB | |
| Hydrochloric Acid SCHEMBL10882631 | 0.85 | CYP3A4 (0.71) | CYP3A4ALDH1A1TSHRCASP1THRB | |
| SCHEMBL9681223 | 0.84 | CYP3A4 (0.61) | CYP3A4ALDH1A1TSHRCASP1THRB | |
| SCHEMBL29169963 | 0.83 | CYP3A4 (0.68) | CYP3A4ALDH1A1TSHRCASP1THRB | |
| SCHEMBL11818157 | 0.81 | CA1 (0.68) | CYP3A4ALDH1A1TSHRCASP1THRB | |
| SCHEMBL7049199 | 0.79 | CYP3A4 (0.63) | CYP3A4ALDH1A1TSHRCASP1THRB | |
| SCHEMBL10797376 | 0.78 | CYP3A4 (0.70) | CYP3A4ALDH1A1TSHRCASP1THRB | |
| Sulfuric Acid SCHEMBL479273 | 0.76 | CYP3A4 (1.00) | CYP3A4ALDH1A1TSHRCASP1THRB |
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 |
|---|---|---|---|---|---|---|---|
| US-7273058-B2 | Dividing hair into individual strands and winding on curlers; prior to application on hair, mixing shaping component with dye component having keratin-reducing agent and 4,5-diaminopyrazole and/or aminophenol derivative(s); fixing, rinsing | WELLA AG (DE) | 2007-09-25 | — | — | US | claimed |
| US-7132001-B2 | 3-aminophenol derivatives and dyes that contain these compounds while serving to dye keratin fibers | WELLA AG (DE) | 2006-11-07 | — | — | US | claimed |