Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.51 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.34 |
| ▸ | AKT2 | P31751 | 2/20 | 0.34 |
| ▸ | AKT1 | P31749 | 1/20 | 0.34 |
| ▸ | MMP13 | P45452 | 1/20 | 0.33 |
| ▸ | MMP14 | P50281 | 1/20 | 0.33 |
| ▸ | XDH | P47989 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 7/20 | 0.33 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.33 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.33 |
| ▸ | TNIK | Q9UKE5 | 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 | |
|---|---|---|---|---|
| SCHEMBL16972674 | 0.80 | KCNH2 (0.47) | KCNH2ACVR1ROCK2PRKCQ | |
| SCHEMBL16984188 | 0.76 | KCNH2 (0.52) | KCNH2 | |
| SCHEMBL16984186 | 0.71 | KCNH2 (0.50) | KCNH2 | |
| SCHEMBL16972695 | 0.68 | KCNH2 (0.61) | KCNH2 | |
| SCHEMBL16984192 | 0.67 | KCNH2 (0.40) | KCNH2 | |
| SCHEMBL16984191 | 0.67 | KCNH2 (0.72) | KCNH2 | |
| SCHEMBL16972673 | 0.66 | KCNH2 (0.66) | KCNH2 | |
| SCHEMBL7895370 | 0.64 | AKT2 (0.59) | AKT2AKT1ROCK2 | |
| SCHEMBL16432987 | 0.63 | AKT2 (0.76) | ACVR1AKT2AKT1ROCK2PRKCQ | |
| SCHEMBL15689115 | 0.63 | AKT2 (0.76) | ACVR1AKT2AKT1ROCK2PRKCQ |
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-2015114317-A1 | 5H-ISOTHIAZOLO[4,5-C]PYRIDINE-3,4-DIONE OR 5H-PYRAZOLO[4,3-C]PYRIDIN-3,4-DIONE AS ANTIBACTERIAL COMPOUNDS | REDX PHARMA PLC (GB) | 2015-08-06 | — | — | WO | disclosed |