Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 5/20 | 0.42 |
| ▸ | NOS1 | P29475 | 5/20 | 0.34 |
| ▸ | NOS3 | P29474 | 4/20 | 0.34 |
| ▸ | MCHR1 | Q99705 | 5/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
| ▸ | EP300 | Q09472 | 1/20 | 0.31 |
| ▸ | CACNA1F | O60840 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | ALB | P02768 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | CACNA1D | Q01668 | 2/20 | 0.31 |
| ▸ | CACNA1S | Q13698 | 2/20 | 0.31 |
| ▸ | CACNA1C | Q13936 | 2/20 | 0.31 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL22248950 | 1.00 | ROCK2 (0.42) | ROCK2NOS1NOS3MCHR1KCNH2 | |
| SCHEMBL22254225 | 0.90 | ROCK2 (0.44) | ROCK2NOS1NOS3MCHR1CHRM2 | |
| SCHEMBL22248453 | 0.88 | ROCK2 (0.41) | ROCK2NOS1NOS3MCHR1CHRM2 | |
| SCHEMBL22249157 | 0.88 | ROCK2 (0.48) | ROCK2MCHR1KCNH2HRH3EP300 | |
| SCHEMBL22248938 | 0.88 | ROCK2 (0.48) | ROCK2MCHR1KCNH2HRH3EP300 | |
| SCHEMBL22248936 | 0.88 | ROCK2 (0.40) | ROCK2NOS1NOS3MCHR1 | |
| SCHEMBL22248946 | 0.86 | ROCK2 (0.46) | ROCK2NOS1NOS3KCNH2 | |
| SCHEMBL22248394 | 0.85 | ROCK2 (0.40) | ROCK2NOS1NOS3MCHR1 | |
| SCHEMBL22248953 | 0.85 | ROCK2 (0.39) | ROCK2NOS1NOS3MCHR1 | |
| SCHEMBL25532068 | 0.84 | ROCK2 (0.45) | ROCK2NOS1NOS3MCHR1CHRM2 |
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-2020150372-A1 | ANTIMICROBIAL COMPOUNDS AND METHODS | CURZA GLOBAL, LLC (US) | 2020-07-23 | — | — | WO | disclosed |