Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 3/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CASP6 | P55212 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | NT5E | P21589 | 2/20 | 0.42 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.41 |
| ▸ | SNCA | P37840 | 1/20 | 0.41 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.40 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.39 |
| ▸ | NSD2 | O96028 | 2/20 | 0.39 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.39 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.39 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.39 |
| ▸ | ENPP2 | Q13822 | 4/20 | 0.38 |
| ▸ | PLG | P00747 | 1/20 | 0.36 |
| ▸ | KLK1 | P06870 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11424933 | 0.92 | ALDH1A1 (0.42) | CYP2C9CYP1A2CASP6ALDH1A1HSD17B10 | |
| SCHEMBL11439237 | 0.91 | CYP2C9 (0.47) | CYP2C9CYP1A2CASP6ALDH1A1HSD17B10 | |
| SCHEMBL11428936 | 0.85 | NT5E (0.50) | CYP2C9CYP1A2CASP6ALDH1A1HSD17B10 | |
| SCHEMBL11440638 | 0.85 | CYP2C9 (0.44) | CYP2C9CYP1A2CASP6ALDH1A1HSD17B10 | |
| SCHEMBL11426442 | 0.84 | KCNMA1 (0.45) | CYP2C9CYP1A2CASP6ALDH1A1NT5E | |
| SCHEMBL11425646 | 0.83 | ALDH1A1 (0.42) | CYP2C9CYP1A2CASP6ALDH1A1HSD17B10 | |
| SCHEMBL11428916 | 0.83 | CASP6 (0.55) | CYP2C9CYP1A2CASP6ALDH1A1HSD17B10 | |
| SCHEMBL11208058 | 0.83 | NT5E (0.62) | CYP2C9CYP1A2CASP6ALDH1A1HSD17B10 | |
| SCHEMBL11433771 | 0.83 | TTR (0.43) | CYP1A2ALDH1A1HSD17B10HKDC1PLG | |
| SCHEMBL11423138 | 0.82 | CYP1A2 (0.44) | CYP2C9CYP1A2CASP6ALDH1A1NT5E |
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-4216165-A | Amine precursors to ureide inhibitors of connective tissue destruction | AMERICAN CYANAMID COMPANY (US) | 1980-08-05 | — | — | US | disclosed |