Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 15/20 | 0.41 |
| ▸ | CACNA1I | Q9P0X4 | 11/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.38 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.37 |
| ▸ | CACNA1H | O95180 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.35 |
| ▸ | CACNA1C | Q13936 | 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 | |
|---|---|---|---|---|
| SCHEMBL5069843 | 0.95 | CACNA1H (0.40) | KCNH2CACNA1IP2RX7SCN5ACACNA1H | |
| SCHEMBL5071693 | 0.92 | NPC1 (0.39) | KCNH2CACNA1ICACNA1HCACNA1G | |
| SCHEMBL5069851 | 0.87 | NPC1 (0.44) | KCNH2CACNA1G | |
| SCHEMBL2888395 | 0.74 | KCNH2 (0.56) | KCNH2CACNA1IP2RX7SCN5ACACNA1H | |
| SCHEMBL5069595 | 0.73 | KCNH2 (0.46) | KCNH2CACNA1IP2RX7SCN5ACACNA1H | |
| SCHEMBL5072499 | 0.71 | P2RX7 (0.41) | KCNH2CACNA1IP2RX7SCN5ACACNA1H | |
| SCHEMBL2885759 | 0.70 | KCNH2 (0.51) | KCNH2CACNA1ISCN5ACACNA1HCYP2D6 | |
| SCHEMBL4275164 | 0.69 | CACNA1I (0.54) | KCNH2CACNA1ICACNA1HCYP2D6CACNA1G | |
| SCHEMBL4275172 | 0.69 | CACNA1I (0.54) | KCNH2CACNA1ICACNA1HCYP2D6CACNA1G | |
| SCHEMBL4282606 | 0.69 | CACNA1I (0.54) | KCNH2CACNA1ICACNA1HCYP2D6CACNA1G |
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-1901746-A2 | 4-FLUORO-PIPERIDINE T-TYPE CALCIUM CHANNEL ANTAGONISTS | Merck & Co., Inc. (US) | 2008-03-26 | — | — | EP | claimed |
| WO-2007002884-A2 | 4-FLUORO-PIPERIDINE T-TYPE CALCIUM CHANNEL ANTAGONISTS | MERCK & CO., INC. (US) | 2007-01-04 | — | — | WO | claimed |