Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1C | Q13936 | 9/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.45 |
| ▸ | MAPT | P10636 | 5/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 5/20 | 0.45 |
| ▸ | MEN1 | O00255 | 5/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | CACNA1F | O60840 | 6/20 | 0.41 |
| ▸ | CACNA1D | Q01668 | 6/20 | 0.41 |
| ▸ | CACNA1S | Q13698 | 6/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | THPO | P40225 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27334169 | 0.84 | CACNA1C (0.47) | CACNA1CCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL27334165 | 0.83 | CACNA1C (0.43) | CACNA1CCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL27334168 | 0.83 | CACNA1C (0.46) | CACNA1CCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL27431194 | 0.82 | CACNA1C (0.47) | CACNA1CCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL27350065 | 0.82 | CACNA1C (0.52) | CACNA1CCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL27333841 | 0.81 | CACNA1C (0.54) | CACNA1CCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL27431195 | 0.81 | CACNA1C (0.54) | CACNA1CCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL27352774 | 0.81 | CACNA1C (0.44) | CACNA1CCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL27334173 | 0.81 | CACNA1C (0.54) | CACNA1CCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL27338681 | 0.81 | CACNA1C (0.46) | CACNA1CCYP1A2CYP3A4CYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1040192-A | New fluorine methoxyphenyl dihydropyridine, its preparation method and the application aspect medicine | BAYER AG (DE) | 1990-03-07 | — | — | CN | disclosed |