Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | CA1 | P00915 | 4/20 | 0.38 |
| ▸ | CA2 | P00918 | 4/20 | 0.38 |
| ▸ | DAPK1 | P53355 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | THRB | P10828 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.37 |
| ▸ | CA9 | Q16790 | 3/20 | 0.36 |
| ▸ | NT5E | P21589 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | CA12 | O43570 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8019424 | 0.85 | CYP2C9 (0.56) | CYP2C9ALDH1A1HSD17B10CA1CA2 | |
| SCHEMBL9631227 | 0.83 | ALDH1A1 (0.47) | ALDH1A1HSD17B10CA1CA2DAPK1 | |
| SCHEMBL19206145 | 0.81 | CYP3A4 (0.41) | CYP2C9ALDH1A1HSD17B10CA1CA2 | |
| SCHEMBL8977584 | 0.79 | CYP3A4 (0.50) | CYP2C9ALDH1A1HSD17B10CA1CA2 | |
| SCHEMBL1955903 | 0.75 | CYP3A4 (0.50) | CYP2C9ALDH1A1HSD17B10CA1CA2 | |
| SCHEMBL9807310 | 0.75 | ALDH1A1 (0.48) | CYP2C9ALDH1A1HSD17B10CA1CA2 | |
| SCHEMBL14395756 | 0.74 | DPP4 (0.41) | CYP2C9ALDH1A1HSD17B10CA1CA2 | |
| SCHEMBL11311119 | 0.73 | ALDH1A1 (0.39) | ALDH1A1HSD17B10CA2DAPK1TSHR | |
| SCHEMBL9349986 | 0.72 | CYP3A4 (0.37) | CYP2C9ALDH1A1HSD17B10CYP3A4TSHR | |
| SCHEMBL5728040 | 0.71 | TSHR (0.48) | CYP2C9ALDH1A1TSHRGAAPOLB |
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-4461827-A | Color photographic recording material containing a non-diffusible dye releaser from which a complexible azo dye is released during development | AGFA-GEVAERT AKTIENGESELLSCHAFT (DE) | 1984-07-24 | — | — | US | disclosed |