Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1G | O43497 | 17/20 | 0.56 |
| ▸ | CACNA1I | Q9P0X4 | 17/20 | 0.56 |
| ▸ | CACNA1H | O95180 | 15/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL17078771 | 0.90 | HDAC1 (0.58) | CACNA1GCACNA1ICACNA1H | |
| SCHEMBL17079016 | 0.90 | CACNA1G (0.54) | CACNA1GCACNA1ICACNA1HCYP3A4 | |
| SCHEMBL20421035 | 0.88 | CACNA1G (0.49) | CACNA1GCACNA1ICACNA1H | |
| SCHEMBL20432835 | 0.86 | CACNA1I (0.54) | CACNA1GCACNA1ICACNA1HCYP3A4 | |
| SCHEMBL20420962 | 0.85 | FAAH (0.51) | — | |
| SCHEMBL20421155 | 0.81 | ALDH1A1 (0.57) | — | |
| SCHEMBL20420940 | 0.81 | LTA4H (0.49) | CYP3A4 | |
| SCHEMBL20420898 | 0.81 | CACNA1G (0.48) | CACNA1GCACNA1ICACNA1H | |
| SCHEMBL20420931 | 0.81 | HDAC1 (0.60) | — | |
| SCHEMBL20420981 | 0.81 | HDAC1 (0.60) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3116859-B1 | NOVEL COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITORS AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME | CHONG KUN DANG PHARMACEUTICAL CORP (KR) | 2018-08-01 | — | — | EP | disclosed |