Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | CACNA2D1 | P54289 | 3/20 | 0.43 |
| ▸ | CACNA1B | Q00975 | 3/20 | 0.43 |
| ▸ | CACNB1 | Q02641 | 3/20 | 0.43 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.43 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 2/20 | 0.41 |
| ▸ | CNR2 | P34972 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | SLC6A9 | P48067 | 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 | |
|---|---|---|---|---|
| SCHEMBL4277413 | 0.83 | NPC1 (0.45) | ALDH1A1CACNA2D1CACNA1BCACNB1CACNA1H | |
| SCHEMBL3494682 | 0.83 | KMT2A (0.39) | CACNA2D1CACNB1KMT2AMEN1 | |
| SCHEMBL8240277 | 0.82 | ALDH1A1 (0.41) | ALDH1A1CACNA2D1CACNA1BCACNB1CACNA1H | |
| SCHEMBL4279035 | 0.82 | GPR119 (0.44) | ALDH1A1KMT2ANPC1KDM4EMAPT | |
| SCHEMBL4283097 | 0.82 | GRM7 (0.44) | ALDH1A1CACNA2D1CACNA1BCACNB1CACNA1H | |
| SCHEMBL13701595 | 0.81 | KMT2A (0.41) | ALDH1A1CACNA2D1CACNA1BCACNB1CACNA1H | |
| SCHEMBL4275669 | 0.81 | NPC1 (0.40) | ALDH1A1CACNA2D1CACNA1BCACNB1CACNA1H | |
| SCHEMBL911824 | 0.80 | ALDH1A1 (0.45) | ALDH1A1CACNA2D1CACNA1BCACNB1CACNA1H | |
| SCHEMBL27402706 | 0.80 | SMN1; SMN2 (0.47) | ALDH1A1KMT2AKDM4EMAPTHPGD | |
| SCHEMBL27407208 | 0.80 | SMN1; SMN2 (0.47) | ALDH1A1KMT2AKDM4EMAPTHPGD |
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-1976841-A1 | HETEROCYCLIC AMIDE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS | Neuromed Pharmaceuticals, Ltd. (CA) | 2008-10-08 | — | — | EP | disclosed |
| WO-2007071035-A1 | HETEROCYCLIC AMIDE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS | NEUROMED PHARMACEUTICALS LTD. (CA) | 2007-06-28 | — | — | WO | disclosed |