Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1C | Q13936 | 6/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | CACNA1F | O60840 | 3/20 | 0.43 |
| ▸ | CACNA1D | Q01668 | 3/20 | 0.43 |
| ▸ | CACNA1S | Q13698 | 3/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3009358 | 0.79 | CACNA1C (0.44) | CACNA1CKDM4EHSD17B10ADORA3ALDH1A1 | |
| SCHEMBL3004149 | 0.76 | ADORA3 (0.60) | CACNA1CKDM4EHSD17B10ADORA3ALDH1A1 | |
| SCHEMBL2999733 | 0.74 | KDM4E (0.45) | CACNA1CKDM4EHSD17B10ADORA3ALDH1A1 | |
| SCHEMBL4265478 | 0.74 | KDM4E (0.52) | CACNA1CKDM4EHSD17B10ADORA3ALDH1A1 | |
| SCHEMBL2994478 | 0.73 | CACNA1C (0.56) | CACNA1CKDM4EHSD17B10ADORA3ALDH1A1 | |
| SCHEMBL3004313 | 0.72 | ALDH1A1 (0.56) | KDM4EHSD17B10ADORA3ALDH1A1CASP1 | |
| SCHEMBL3009592 | 0.71 | KDM4E (0.46) | KDM4EHSD17B10ADORA3ALDH1A1CASP1 | |
| SCHEMBL2993757 | 0.71 | PDE1C (0.41) | CACNA1CHSD17B10ADORA3ALDH1A1CYP3A4 | |
| SCHEMBL4059888 | 0.70 | TSHR (0.54) | HSD17B10ALDH1A1CYP2C9MEN1CYP1A2 | |
| SCHEMBL4252896 | 0.70 | MAPT (0.48) | CACNA1CKDM4EHSD17B10ADORA3ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009006580-A1 | OPTIONALLY CONDENSED DIHYDROPYRIDINE, DIHYDROPYRIMIDINE AND DIHYDROPYRANE DERIVATIVES ACTING AS LATE SODIUM CHANNEL BLOCKERS | CV THERAPEUTICS, INC. (US) | 2009-01-08 | — | — | WO | disclosed |