Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | TNF | P01375 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.39 |
| ▸ | PARP4 | Q9UKK3 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | HPGDS | O60760 | 4/20 | 0.38 |
| ▸ | ACACB | O00763 | 1/20 | 0.37 |
| ▸ | VNN1 | O95497 | 1/20 | 0.36 |
| ▸ | APLNR | P35414 | 2/20 | 0.36 |
| ▸ | DCAF1 | Q9Y4B6 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1871235 | 0.82 | CACNA1I (0.53) | CACNA1IL3MBTL1 | |
| SCHEMBL19738832 | 0.80 | CACNA1I (0.46) | CACNA1ICA1CA2PARP10PARP1 | |
| SCHEMBL29376832 | 0.80 | CACNA1I (0.46) | CACNA1ICA1CA2PARP10PARP1 | |
| SCHEMBL3728573 | 0.78 | APLNR (0.50) | APLNR | |
| SCHEMBL19716796 | 0.78 | CACNA1I (0.44) | CACNA1ICA1CA2PARP10PARP1 | |
| SCHEMBL19464658 | 0.77 | CACNA1I (0.43) | CACNA1ICA1CA2GAAAPLNR | |
| SCHEMBL27692987 | 0.76 | CACNA1I (0.48) | CACNA1ICA1CA2HTTHPGDS | |
| SCHEMBL12883281 | 0.76 | TNF (0.54) | L3MBTL1TNFCA1CA2PARP10 | |
| SCHEMBL1063334 | 0.73 | CACNA1I (0.42) | CACNA1ICA1CA2 | |
| SCHEMBL14864691 | 0.73 | CACNA1I (0.48) | CACNA1ICA1CA2ACACBAPLNR |
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-2010493-A2 | PYRIDYL AMIDE T-TYPE CALCIUM CHANNEL ANTAGONISTS | Merck & Co., Inc. (US) | 2009-01-07 | — | — | EP | disclosed |
| WO-2007120729-A2 | PYRIDYL AMIDE T-TYPE CALCIUM CHANNEL ANTAGONISTS | MERCK & CO., INC. (US) | 2007-10-25 | — | — | WO | disclosed |