Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.48 |
| ▸ | CACNA1C | Q13936 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.40 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.39 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.39 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | CACNA1B | Q00975 | 4/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3248414 | 0.89 | MAPT (0.57) | MAPTNPSR1CACNA1CKDM4EALDH1A1 | |
| SCHEMBL4252894 | 0.81 | MAPT (0.46) | MAPTNPSR1CACNA1CKDM4EALDH1A1 | |
| SCHEMBL3005453 | 0.77 | MAPT (0.52) | MAPTNPSR1CACNA1CKDM4EALDH1A1 | |
| SCHEMBL3266020 | 0.77 | MAPT (0.49) | MAPTNPSR1CACNA1CKDM4EALDH1A1 | |
| SCHEMBL2996737 | 0.76 | MAPT (0.70) | MAPTNPSR1CACNA1CKDM4EALDH1A1 | |
| SCHEMBL2999733 | 0.76 | KDM4E (0.45) | MAPTNPSR1CACNA1CKDM4EALDH1A1 | |
| SCHEMBL3237974 | 0.76 | TSHR (0.44) | MAPTNPSR1HSD17B10CACNA1BTSHR | |
| SCHEMBL4265478 | 0.74 | KDM4E (0.52) | MAPTNPSR1CACNA1CKDM4EALDH1A1 | |
| SCHEMBL3005544 | 0.73 | CACNA1C (0.45) | MAPTNPSR1CACNA1CKDM4EALDH1A1 | |
| SCHEMBL11829270 | 0.73 | CYP2C9 (0.67) | MAPTNPSR1CACNA1CKDM4EALDH1A1 |
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 |