Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.37 |
| ▸ | PDE10A | Q9Y233 | 12/20 | 0.36 |
| ▸ | PBK | Q96KB5 | 4/20 | 0.35 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.33 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4050701 | 0.76 | PBK (0.41) | EGLN1PBK | |
| SCHEMBL1299454 | 0.70 | HTR2B (0.52) | HTR2B | |
| SCHEMBL4055604 | 0.69 | METAP2 (0.35) | PBK | |
| SCHEMBL1304590 | 0.67 | PDE10A (0.43) | PDE10A | |
| SCHEMBL1740554 | 0.67 | CYP2C9 (0.46) | PDE10A | |
| SCHEMBL30515605 | 0.67 | KDM4E (0.53) | EGLN1 | |
| SCHEMBL21435110 | 0.66 | HPGDS (0.34) | HTR2B | |
| SCHEMBL1740546 | 0.65 | PDE10A (0.40) | PDE10A | |
| SCHEMBL21435247 | 0.65 | HPGDS (0.35) | HTR2B | |
| SCHEMBL2595525 | 0.64 | HTR2B (0.50) | HTR2BPDE10A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009029592-A1 | HETEROBICYCLIC-SUBSTITUTED QUINOLONES USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS | KALYPSYS, INC. (US) | 2009-03-05 | — | — | WO | disclosed |