Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1C | Q13936 | 7/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | CACNA1F | O60840 | 4/20 | 0.46 |
| ▸ | CACNA1D | Q01668 | 4/20 | 0.46 |
| ▸ | CACNA1S | Q13698 | 4/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8928269 | 0.85 | SMN1; SMN2 (0.46) | MAPTALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL8928277 | 0.84 | CACNA1C (0.54) | CACNA1CCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL6137184 | 0.79 | CACNA1C (0.64) | CACNA1CCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL7586726 | 0.78 | CACNA1C (0.60) | CACNA1CCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL7586763 | 0.76 | CACNA1C (0.60) | CACNA1CCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL7590982 | 0.75 | CACNA1F (0.80) | CACNA1CCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL7588425 | 0.73 | ABCC1 (0.57) | CACNA1CCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL8928255 | 0.73 | CHRNA7 (0.44) | CYP1A2CYP3A4CYP2C9CYP2C19MAPT | |
| SCHEMBL7269131 | 0.73 | CACNA1F (0.54) | CACNA1CCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL30357940 | 0.73 | CACNA1F (0.54) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0755931-A1 | Dihydropyridine and pyridine derivatives and process for their preparation | PHARMACIA & UPJOHN S.p.A. (IT) | 1997-01-29 | — | — | EP | claimed |
| EP-0755931-A1 | Dihydropyridine and pyridine derivatives and process for their preparation | PHARMACIA & UPJOHN S.p.A. (IT) | 1997-01-29 | — | — | EP | disclosed |