Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 8/20 | 0.38 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | HTR4 | Q13639 | 2/20 | 0.37 |
| ▸ | CACNA1I | Q9P0X4 | 7/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19113009 | 0.88 | KCNH2 (0.41) | KDM1AKCNH2CACNA1HCYP2D6GSK3B | |
| SCHEMBL4271496 | 0.88 | KCNH2 (0.50) | KCNH2CACNA1HCYP2D6GSK3BHTR4 | |
| SCHEMBL1428801 | 0.78 | KDM1A (0.46) | KDM1AKCNH2CACNA1HCYP2D6GSK3B | |
| SCHEMBL14770035 | 0.77 | KCNH2 (0.54) | KCNH2CACNA1HCYP2D6GSK3BHTR4 | |
| SCHEMBL13569937 | 0.76 | KCNH2 (0.51) | KCNH2CACNA1HCYP2D6GSK3BHTR4 | |
| SCHEMBL4275652 | 0.75 | CACNA1I (0.67) | KCNH2CACNA1HCYP2D6CACNA1I | |
| SCHEMBL4273130 | 0.75 | CACNA1I (0.49) | KDM1AKCNH2CACNA1HCYP2D6GSK3B | |
| SCHEMBL4279835 | 0.74 | KCNH2 (0.49) | KCNH2CACNA1HCYP2D6GSK3BHTR4 | |
| SCHEMBL13569919 | 0.74 | CACNA1I (0.51) | KCNH2CACNA1HCYP2D6GSK3BHTR4 | |
| SCHEMBL4272143 | 0.74 | KCNH2 (0.47) | KDM1AKCNH2CACNA1HCYP2D6GSK3B |
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 |
|---|---|---|---|---|---|---|---|
| EP-3189839-B1 | N-PIPERIDINYL ACETAMIDE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS | PRAXIS PREC MEDICINES INC (US) | 2020-05-20 | — | — | EP | disclosed |