Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 4/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 8/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 8/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 8/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 8/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | SMYD3 | Q9H7B4 | 3/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | CACNA1I | Q9P0X4 | 3/20 | 0.32 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | HRH1 | P35367 | 1/20 | 0.32 |
| ▸ | HTR4 | Q13639 | 1/20 | 0.32 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3824638 | 0.93 | KCNH2 (0.46) | KCNH2CYP2D6SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3830481 | 0.91 | CACNA1H (0.41) | KCNH2CYP2D6SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3830817 | 0.88 | KCNH2 (0.51) | KCNH2CYP2D6SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3827185 | 0.87 | NPC1 (0.43) | KCNH2POLBGAACACNA1GKDM4E | |
| SCHEMBL3824589 | 0.82 | SLC6A2 (0.45) | KCNH2CYP2D6SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3830150 | 0.81 | KCNH2 (0.42) | KCNH2CYP2D6SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3824456 | 0.73 | KCNH2 (0.44) | KCNH2CYP2D6CACNA1ICACNA1GCHRM2 | |
| SCHEMBL3824148 | 0.73 | KCNH2 (0.46) | KCNH2CYP2D6CACNA1ICACNA1GCHRM2 | |
| SCHEMBL3824215 | 0.73 | KCNH2 (0.44) | KCNH2CYP2D6CACNA1ICACNA1GCHRM2 | |
| SCHEMBL3827202 | 0.71 | KCNH2 (0.41) | KCNH2CYP2D6SLC6A2SLC6A4SLC6A3 |
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 |