Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLKB1 | P03952 | 12/20 | 0.35 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.33 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.33 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | AADAT | Q8N5Z0 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL371003 | 0.84 | KLKB1 (0.36) | KLKB1CACNA1GCACNA1HCACNA1IKMT2A | |
| SCHEMBL369326 | 0.84 | CACNA1G (0.40) | KLKB1CACNA1GCACNA1HCACNA1IKMT2A | |
| SCHEMBL369161 | 0.84 | KMT2A (0.41) | CACNA1GCACNA1HCACNA1IKMT2AL3MBTL1 | |
| SCHEMBL370149 | 0.81 | CACNA1G (0.34) | KLKB1CACNA1GCACNA1HCACNA1IKMT2A | |
| SCHEMBL371167 | 0.78 | HSP90AA1 (0.31) | KLKB1CACNA1GCACNA1HCACNA1IAADAT | |
| SCHEMBL369366 | 0.76 | CACNA1G (0.40) | KLKB1CACNA1GCACNA1HCACNA1IKMT2A | |
| SCHEMBL369607 | 0.76 | KLKB1 (0.47) | KLKB1CACNA1GCACNA1HCACNA1IKMT2A | |
| SCHEMBL369221 | 0.76 | CACNA1G (0.41) | KLKB1CACNA1GCACNA1HCACNA1IKMT2A | |
| SCHEMBL370510 | 0.75 | FLT3 (0.39) | KLKB1CACNA1GCACNA1HCACNA1IKMT2A | |
| SCHEMBL368790 | 0.74 | KLKB1 (0.47) | KLKB1AADAT |
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-2592932-A2 | NOVEL TETRAHYDROPYRAZOLO[3,4-B]AZEPINE DERIVATIVES AND THEIR USE AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS | Addex Pharma SA (CH) | 2013-05-22 | — | — | EP | disclosed |
| WO-2012009001-A2 | NOVEL TETRAHYDROPYRAZOLO[3,4-B]AZEPINE DERIVATIVES AND THEIR USE AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS | ADDEX PHARMA S.A. (CH) | 2012-01-19 | — | — | WO | disclosed |