Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA2D1 | P54289 | 12/20 | 0.43 |
| ▸ | CACNA1B | Q00975 | 12/20 | 0.43 |
| ▸ | CACNB1 | Q02641 | 12/20 | 0.43 |
| ▸ | CACNA1C | Q13936 | 10/20 | 0.43 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CACNA1G | O43497 | 5/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6983252 | 0.92 | CACNA1B (0.36) | CACNA2D1CACNA1BCACNB1CACNA1C | |
| SCHEMBL6975998 | 0.88 | TSHR (0.44) | — | |
| SCHEMBL6977659 | 0.85 | L3MBTL1 (0.45) | TDP1 | |
| SCHEMBL6974103 | 0.83 | NPC1 (0.48) | CACNA1CTDP1 | |
| Hydrochloric Acid SCHEMBL6984864 | 0.83 | OPRL1 (0.38) | — | |
| Hydrochloric Acid SCHEMBL6982807 | 0.82 | SIGMAR1 (0.42) | KCNH2 | |
| SCHEMBL6984706 | 0.79 | ALDH1A1 (0.40) | — | |
| Hydrochloric Acid SCHEMBL6984801 | 0.78 | SMN1; SMN2 (0.43) | KCNH2 | |
| SCHEMBL6981795 | 0.78 | POLB (0.47) | — | |
| SCHEMBL6981070 | 0.77 | SIGMAR1 (0.41) | KCNH2 |
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-0923575-B1 | CYCLIC ETHER COMPOUNDS AS SODIUM CHANNEL MODULATORS | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2003-03-12 | — | — | EP | disclosed |
| US-6172085-B1 | CENTRAL NERVOUS SYSTEM AND PSYCHOLOGICAL DISORDERS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2001-01-09 | — | — | US | disclosed |