Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1H | O95180 | 12/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.33 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.32 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 2/20 | 0.31 |
| ▸ | CA2 | P00918 | 2/20 | 0.31 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.31 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.31 |
| ▸ | WDR5 | P61964 | 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 | |
|---|---|---|---|---|
| SCHEMBL19302498 | 0.80 | SIGMAR1 (0.39) | CACNA1HSIGMAR1EPHX2NR1H4OPRL1 | |
| SCHEMBL24196140 | 0.80 | LOXL2 (0.41) | CACNA1HSIGMAR1 | |
| SCHEMBL21036238 | 0.80 | PDK2 (0.37) | CACNA1HSIGMAR1EPHX2NR1H4CACNA1G | |
| SCHEMBL24196137 | 0.77 | PDK2 (0.39) | CACNA1HSIGMAR1OPRL1CA2 | |
| SCHEMBL25801644 | 0.76 | CACNA1H (0.39) | CACNA1HSIGMAR1CACNA1GCYP3A4CYP2C8 | |
| SCHEMBL25735734 | 0.76 | PDK2 (0.40) | CACNA1HSIGMAR1EPHX2NR1H4 | |
| SCHEMBL26014791 | 0.76 | PTGS1 (0.40) | SIGMAR1CYP2C9 | |
| SCHEMBL24851952 | 0.74 | TRPA1 (0.30) | — | |
| SCHEMBL24298656 | 0.73 | GSK3B (0.47) | CACNA1HSIGMAR1EPHX2NR1H4KDM4C | |
| SCHEMBL24298716 | 0.73 | PDE2A (0.36) | CACNA1HSIGMAR1EPHX2NR1H4WDR5 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019104011-A1 | CERAMIDE GALACTOSYLTRANSFERASE INHIBITORS FOR THE TREATMENT OF DISEASE | BIOMARIN PHARMACEUTICAL INC. (US) | 2019-05-31 | — | — | WO | disclosed |