Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PYCR1 | P32322 | 10/20 | 0.41 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.32 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.32 |
| ▸ | PRMT8 | Q9NR22 | 1/20 | 0.32 |
| ▸ | LSS | P48449 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL1472490 | 0.98 | PYCR1 (0.40) | PYCR1P2RX7HRH3KDM4EALDH1A1 | |
| SCHEMBL12749574 | 0.82 | PYCR1 (0.52) | PYCR1HRH3 | |
| SCHEMBL21962259 | 0.81 | PYCR1 (0.53) | PYCR1KDM4EALDH1A1TSHRMAOB | |
| SCHEMBL4632355 | 0.81 | PYCR1 (0.41) | PYCR1HRH3KDM4EALDH1A1MAOB | |
| SCHEMBL1472497 | 0.81 | NR1I2 (0.42) | PYCR1HRH3KDM4EALDH1A1TSHR | |
| SCHEMBL23032284 | 0.80 | ALDH1A1 (0.52) | PYCR1KDM4EALDH1A1TSHRMAOB | |
| Hydrochloric Acid SCHEMBL25237515 | 0.78 | ALDH1A1 (0.52) | PYCR1KDM4EALDH1A1TSHRMAOB | |
| SCHEMBL1009445 | 0.77 | PYCR1 (0.38) | PYCR1HRH3KDM4EALDH1A1TSHR | |
| SCHEMBL17540309 | 0.77 | PYCR1 (0.41) | PYCR1HRH3ALDH1A1LSS | |
| SCHEMBL4631973 | 0.77 | CYP2A6 (0.46) | PYCR1HRH3MAOBLSS |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2094706-B1 | SUBSTITUTED 2,5-DFFLYDRO-3H-PYRAZOLO[4,3-C]PYRIDAZIN-3-ONE DERIVATIVES, PREPARATION THEREOF AND USE OF SAME AS CANNABINOID CB1 RECEPTOR LIGANDS | SANOFI AVENTIS (FR) | 2011-01-05 | — | — | EP | disclosed |
| EP-2094706-A2 | SUBSTITUTED 2,5-DFFLYDRO-3H-PYRAZOLO[4,3-C]PYRIDAZIN-3-ONE DERIVATIVES, PREPARATION THEREOF AND USE OF SAME AS CANNABINOID CB1 RECEPTOR LIGANDS | Sanofi-Aventis (FR) | 2009-09-02 | — | — | EP | disclosed |
| WO-2008068424-A2 | SUBSTITUTED 2,5-DIHYDRO-3H-PYRAZOLO[4,3-C]PYRIDAZIN-3-ONE DERIVATIVES, PREPARATION THEREOF AND USE OF SAME AS CANNABINOID CB1 RECEPTOR LIGANDS | SANOFI-AVENTIS (FR) | 2008-06-12 | — | — | WO | disclosed |