Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VKORC1 | Q9BQB6 | 1/20 | 0.34 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.31 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.31 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.31 |
| ▸ | PARP1 | P09874 | 1/20 | 0.30 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| SCHEMBL9541340 | 0.73 | PDE3B (0.37) | VKORC1PDE3BPDE3A | |
| SCHEMBL9542605 | 0.71 | ALOX5 (0.42) | VKORC1PDE3BPDE3AALOX5PARP1 | |
| SCHEMBL9539844 | 0.67 | PDE3B (0.37) | VKORC1PDE3BPDE3A | |
| SCHEMBL9542481 | 0.56 | HSD17B10 (0.37) | — | |
| SCHEMBL12834567 | 0.55 | STAT3 (0.49) | MAOB | |
| SCHEMBL27561174 | 0.55 | ALDH1A1 (0.40) | — | |
| SCHEMBL4814389 | 0.55 | TRPA1 (0.45) | — | |
| SCHEMBL7205047 | 0.54 | MAPT (0.46) | PARP1 | |
| SCHEMBL2250646 | 0.54 | KEAP1 (0.70) | ALOX5 | |
| SCHEMBL68691 | 0.53 | GABRA1 (0.48) | — |
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-1993014086-A1 | SUBSTITUTED 1-ISOQUINOLONE DERIVATIVES AS ANGIOTENSIN II ANTAGONISTS | SYNTEX (U.S.A.) INC. (US) | 1993-07-22 | — | — | WO | disclosed |