Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1I | Q9P0X4 | 15/20 | 0.79 |
| ▸ | KCNH2 | Q12809 | 11/20 | 0.79 |
| ▸ | CACNA1G | O43497 | 2/20 | 0.79 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.79 |
| ▸ | HRH1 | P35367 | 1/20 | 0.79 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.79 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.79 |
| ▸ | CACNA1H | O95180 | 4/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 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 | |
|---|---|---|---|---|
| SCHEMBL3513007 | 1.00 | CACNA1I (0.79) | CACNA1IKCNH2CACNA1GCHRM2HRH1 | |
| SCHEMBL3824642 | 0.93 | CACNA1I (0.89) | CACNA1IKCNH2CACNA1GCHRM2HRH1 | |
| SCHEMBL3514784 | 0.93 | CACNA1I (0.89) | CACNA1IKCNH2CACNA1GCHRM2HRH1 | |
| SCHEMBL3518297 | 0.92 | CACNA1I (0.71) | CACNA1IKCNH2CACNA1GCHRM2HRH1 | |
| SCHEMBL3517665 | 0.91 | CACNA1I (0.70) | CACNA1IKCNH2CACNA1GCHRM2HRH1 | |
| SCHEMBL3830482 | 0.91 | CACNA1I (0.70) | CACNA1IKCNH2CACNA1GCHRM2HRH1 | |
| SCHEMBL13168110 | 0.90 | CACNA1I (0.71) | CACNA1IKCNH2CACNA1GCHRM2HRH1 | |
| SCHEMBL3515940 | 0.90 | CACNA1I (0.71) | CACNA1IKCNH2CACNA1GCHRM2HRH1 | |
| SCHEMBL3515933 | 0.89 | CACNA1I (0.79) | CACNA1IKCNH2CACNA1GCHRM2HRH1 | |
| SCHEMBL8245108 | 0.89 | CACNA1I (0.79) | CACNA1IKCNH2CACNA1GCHRM2HRH1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1896414-A4 | 3-FLUORO-PIPERIDINE T-TYPE CALCIUM CHANNEL ANTAGONISTS | MERCK & CO INC (US) | 2009-09-09 | — | — | EP | claimed |
| EP-1896414-A2 | 3-FLUORO-PIPERIDINE T-TYPE CALCIUM CHANNEL ANTAGONISTS | Merck & Co., Inc. (US) | 2008-03-12 | — | — | EP | claimed |
| WO-2007002361-A2 | 3-FLUORO-PIPERIDINE T-TYPE CALCIUM CHANNEL ANTAGONISTS | MERCK & CO., INC. (US) | 2007-01-04 | — | — | WO | claimed |