Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | CASP6 | P55212 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 2/20 | 0.31 |
| ▸ | CA2 | P00918 | 2/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10978163 | 0.75 | NT5E (0.38) | CASP6HSD17B10CA1CA2CA9 | |
| SCHEMBL5702855 | 0.71 | ALDH1A1 (0.43) | ALDH1A1CYP2C9CYP2C19CASP6HSD17B10 | |
| SCHEMBL9650734 | 0.70 | ALDH1A1 (0.43) | ALDH1A1CYP2C9CYP2C19CASP6HSD17B10 | |
| SCHEMBL9841095 | 0.70 | ROCK1 (0.44) | ALDH1A1CYP2C9CYP2C19CASP6HSD17B10 | |
| SCHEMBL10429484 | 0.69 | CA1 (0.39) | CA1CA2CA9 | |
| SCHEMBL10982417 | 0.68 | NT5E (0.45) | ALDH1A1CYP2C9CYP2C19CASP6HSD17B10 | |
| SCHEMBL9002486 | 0.68 | RECQL (0.48) | ALDH1A1CA1CA2CA9 | |
| SCHEMBL9133787 | 0.66 | MAOB (0.50) | ALDH1A1HSD17B10CA1CA2CA9 | |
| SCHEMBL9841088 | 0.66 | ALDH1A1 (0.37) | ALDH1A1CYP2C9CYP2C19CASP6HSD17B10 | |
| SCHEMBL11152201 | 0.66 | ALDH1A1 (0.37) | PTGS2ALDH1A1CYP2C9CYP2C19CASP6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4530996-A | Containing naphthalene rings | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1985-07-23 | — | — | US | disclosed |
| EP-0068204-B1 | REACTIVE MONO-FUNCTIONAL BISAZO BLUE-BLACK DYE | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1985-04-24 | — | — | EP | disclosed |
| EP-0068204-A1 | Reactive mono-functional bisazo blue-black dye | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1983-01-05 | — | — | EP | disclosed |