Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AADAT | Q8N5Z0 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.39 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.39 |
| ▸ | CMA1 | P23946 | 1/20 | 0.39 |
| ▸ | PDE1A | P54750 | 1/20 | 0.39 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.39 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.36 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.36 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL370873 | 0.76 | AADAT (0.39) | AADATHSP90AA1HSP90AB1CMA1PDE1B | |
| SCHEMBL369528 | 0.76 | KMT2A (0.43) | AADATHSP90AA1HSP90AB1PDE1APDE1B | |
| SCHEMBL3696651 | 0.75 | GAA (0.46) | AADATHSP90AA1HSP90AB1CMA1RAB9A | |
| SCHEMBL370600 | 0.74 | KLKB1 (0.43) | AADATHSP90AA1HSP90AB1PDE1APDE1B | |
| SCHEMBL26106761 | 0.71 | RAB9A (0.50) | AADATHSP90AA1HSP90AB1CMA1RAB9A | |
| SCHEMBL21796563 | 0.70 | RAB9A (0.49) | AADATHSP90AA1HSP90AB1CMA1RAB9A | |
| SCHEMBL21518857 | 0.69 | SMN1; SMN2 (0.45) | AADATRAB9AL3MBTL1DUSP3SMN1; SMN2 | |
| SCHEMBL26622753 | 0.69 | L3MBTL1 (0.49) | HSP90AA1HSP90AB1CMA1PDE1APDE1B | |
| SCHEMBL370819 | 0.69 | CMA1 (0.44) | AADATHSP90AA1HSP90AB1CMA1RAB9A | |
| SCHEMBL20226401 | 0.68 | HSP90AA1 (0.45) | AADATHSP90AA1HSP90AB1CMA1PDE1A |
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-2593277-A2 | NOVEL FUSED PYRAZOLE DERIVATIVES AND THEIR USE AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS | ADDEX Pharma S.A. (CH) | 2013-05-22 | — | — | EP | disclosed |
| WO-2012009000-A2 | NOVEL FUSED PYRAZOLE DERIVATIVES AND THEIR USE AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS | ADDEX PHARMA S.A. (CH) | 2012-01-19 | — | — | WO | disclosed |