Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | GSK3B | P49841 | 1/20 | 0.31 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.30 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7545063 | 0.95 | CSNK2A1 (0.35) | CSNK2A1CYP1A2GSK3B | |
| SCHEMBL7549769 | 0.89 | NQO2 (0.34) | CYP1A2PDE3BPDE3A | |
| SCHEMBL7550534 | 0.78 | PDE3B (0.44) | PDE3BPDE3A | |
| SCHEMBL7550176 | 0.78 | CHEK1 (0.38) | PDE3BPDE3A | |
| SCHEMBL7549280 | 0.76 | PDE3B (0.46) | CYP1A2PDE3BPDE3A | |
| SCHEMBL7547477 | 0.73 | KDM4E (0.44) | CSNK2A1CYP1A2GSK3BPDE3BPDE3A | |
| SCHEMBL7499243 | 0.72 | — | — | |
| SCHEMBL7506993 | 0.69 | — | — | |
| SCHEMBL26684832 | 0.61 | AHR (0.33) | CSNK2A1 | |
| SCHEMBL29998995 | 0.61 | NPC1 (0.36) | CSNK2A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0931081-B1 | PYRIDAZINO 4,5-B]-QUINOLINE 5-OXIDE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS GLYCINE ANTAGONISTS | MERZ & CO GMBH & CO (DE) | 2002-09-25 | — | — | EP | claimed |