Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7265677 | 0.89 | CYP2C9 (0.46) | KDM4EALDH1A1CYP2C9MEN1CYP1A2 | |
| SCHEMBL10995927 | 0.89 | KDM4E (0.46) | MAPK1PTGDRPTGDR2KDM4EALDH1A1 | |
| SCHEMBL7265650 | 0.86 | ABCC1 (0.32) | MAPK1KDM4EALDH1A1RECQLCYP2C9 | |
| SCHEMBL7270521 | 0.86 | KMT2A (0.35) | MAPK1KDM4EALDH1A1RECQLCYP2C9 | |
| SCHEMBL7264418 | 0.85 | KDM4E (0.33) | KDM4EALDH1A1MEN1KMT2AHSD17B10 | |
| SCHEMBL7263910 | 0.82 | POLB (0.41) | MAPK1ALDH1A1CYP2C9MEN1CYP1A2 | |
| SCHEMBL7265647 | 0.81 | KMT2A (0.35) | MAPK1KDM4EALDH1A1CYP2C9MEN1 | |
| SCHEMBL7271627 | 0.80 | CYP2C9 (0.47) | KDM4EALDH1A1CYP2C9MEN1CYP1A2 | |
| SCHEMBL7265522 | 0.80 | CYP2C9 (0.42) | MAPK1KDM4EALDH1A1CYP2C9MEN1 | |
| SCHEMBL7271866 | 0.80 | CYP2C9 (0.46) | KDM4EALDH1A1CYP2C9MEN1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0116708-A1 | Substituted 1,4-dihydropyridines, method for their preparation and their use as pharmaceuticals | CASSELLA Aktiengesellschaft (DE) | 1984-08-29 | — | — | EP | disclosed |