Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.46 |
| ▸ | CASP6 | P55212 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | CD44 | P16070 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 5/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | NT5E | P21589 | 2/20 | 0.37 |
| ▸ | CA12 | O43570 | 3/20 | 0.37 |
| ▸ | CA1 | P00915 | 3/20 | 0.37 |
| ▸ | CA9 | Q16790 | 3/20 | 0.37 |
| ▸ | CA3 | P07451 | 1/20 | 0.37 |
| ▸ | CA4 | P22748 | 1/20 | 0.37 |
| ▸ | CA6 | P23280 | 1/20 | 0.37 |
| ▸ | CA5A | P35218 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL30586216 | 0.89 | CD44 (0.52) | ALDH1A1HSD17B10CD44CA2TSHR | |
| SCHEMBL72936 | 0.87 | CD44 (0.54) | ALDH1A1HSD17B10CD44CA2TSHR | |
| SCHEMBL29489238 | 0.87 | CD44 (0.54) | ALDH1A1HSD17B10CD44CA2TSHR | |
| SCHEMBL9706822 | 0.86 | CD44 (0.52) | ALDH1A1HSD17B10CD44CA2TSHR | |
| SCHEMBL9753030 | 0.84 | CD44 (0.55) | ALDH1A1HSD17B10CD44CA2TSHR | |
| SCHEMBL149375 | 0.82 | ALDH1A1 (0.64) | ALDH1A1HSD17B10CASP6CYP2C9CYP2C19 | |
| SCHEMBL342537 | 0.82 | ALDH1A1 (0.64) | ALDH1A1HSD17B10CASP6CYP2C9CYP2C19 | |
| SCHEMBL29702840 | 0.82 | ALDH1A1 (0.64) | ALDH1A1HSD17B10CASP6CYP2C9CYP2C19 | |
| SCHEMBL9637525 | 0.81 | CA2 (0.56) | ALDH1A1HSD17B10CASP6CYP2C9CYP2C19 | |
| SCHEMBL11506233 | 0.81 | LMNA (0.43) | ALDH1A1HSD17B10CASP6CYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-5026831-A | Water-insoluble disazo colorants having hetero-bicyclic methylene-active compounds as coupling component | HOECHST AKTIENGESELLSCHAFT (DE) | 1991-06-25 | — | — | US | disclosed |