Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 11/20 | 0.60 |
| ▸ | CACNA1I | Q9P0X4 | 11/20 | 0.60 |
| ▸ | MCHR1 | Q99705 | 3/20 | 0.45 |
| ▸ | HTR1A | P08908 | 1/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.45 |
| ▸ | HTR2B | P41595 | 1/20 | 0.45 |
| ▸ | CCR2 | P41597 | 1/20 | 0.41 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.40 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL14769919 | 0.85 | KCNH2 (0.66) | KCNH2CACNA1IMCHR1HTR1AADRA2A | |
| SCHEMBL19112594 | 0.83 | KCNH2 (0.63) | KCNH2CACNA1IMCHR1HTR1AADRA2A | |
| SCHEMBL1427896 | 0.83 | KCNH2 (0.62) | KCNH2CACNA1IMCHR1HTR1AADRA2A | |
| SCHEMBL4278940 | 0.83 | KCNH2 (0.60) | KCNH2CACNA1IMCHR1HTR1AADRA2A | |
| SCHEMBL19112701 | 0.81 | KCNH2 (0.60) | KCNH2CACNA1IMCHR1HTR1AADRA2A | |
| SCHEMBL7797275 | 0.80 | CACNA1I (0.60) | KCNH2CACNA1IMCHR1HTR1AADRA2A | |
| SCHEMBL1428777 | 0.80 | KCNH2 (0.57) | KCNH2CACNA1IMCHR1HTR1AADRA2A | |
| SCHEMBL4270480 | 0.80 | KCNH2 (0.55) | KCNH2CACNA1IMCHR1HTR1AADRA2A | |
| SCHEMBL1428180 | 0.80 | KCNH2 (0.59) | KCNH2CACNA1IMCHR1HTR1AADRA2A | |
| SCHEMBL4278118 | 0.80 | KCNH2 (0.59) | KCNH2CACNA1IMCHR1HTR1AADRA2A |
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-A1 | N-PIPERIDINYL ACETAMIDE DERIVATIVES AS CALCIUM CHANNEL BLOCKERS | Taro Pharmaceuticals Inc. (CA) | 2017-07-12 | — | — | EP | disclosed |