Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE1A | P54750 | 6/20 | 0.39 |
| ▸ | PDE1B | Q01064 | 6/20 | 0.39 |
| ▸ | PDE1C | Q14123 | 6/20 | 0.39 |
| ▸ | PDE2A | O00408 | 2/20 | 0.39 |
| ▸ | HRH1 | P35367 | 4/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.37 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | PDE9A | O76083 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | CCR2 | P41597 | 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 | |
|---|---|---|---|---|
| SCHEMBL13628839 | 0.85 | PDE2A (0.34) | PDE1APDE1BPDE1CPDE2AHRH1 | |
| SCHEMBL13176309 | 0.79 | PDE1A (0.42) | PDE1APDE1BPDE1CPDE2AHRH1 | |
| SCHEMBL2920935 | 0.78 | PTGS2 (0.49) | PDE1APDE1BPDE1CPDE2AHRH1 | |
| SCHEMBL13628840 | 0.76 | PTGS2 (0.35) | PTGS2CCR2 | |
| SCHEMBL13628832 | 0.73 | TRPC5 (0.38) | PTGS2CNR1CNR2HSD17B10 | |
| SCHEMBL13628859 | 0.72 | PTGS2 (0.45) | PTGS2 | |
| SCHEMBL13628853 | 0.72 | PTGS2 (0.37) | PTGS2 | |
| SCHEMBL13628857 | 0.71 | CCR2 (0.40) | PTGS2CCR2 | |
| SCHEMBL13628824 | 0.71 | RAB9A (0.36) | PTGS2 | |
| SCHEMBL13628847 | 0.69 | CYP11B2 (0.43) | PTGS2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7612070-B2 | Heterocyclic compounds as antiinflammatory agents and cyclooxygenase inhibitors | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2009-11-03 | — | — | US | disclosed |