Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Nitric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 6/20 | 0.39 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.39 |
| ▸ | THRB | P10828 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | NAMPT | P43490 | 3/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | AKT1 | P31749 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL28573833 | 0.89 | ROCK2 (0.38) | ROCK2ROCK1THRBGAAHDAC1 | |
| SCHEMBL30744184 | 0.88 | ROCK2 (0.44) | ROCK2ROCK1THRBNPC1MEN1 | |
| SCHEMBL30744194 | 0.88 | ROCK2 (0.43) | ROCK2ROCK1GAAMEN1KMT2A | |
| SCHEMBL23501278 | 0.88 | ROCK2 (0.44) | ROCK2ROCK1THRBNPC1MEN1 | |
| SCHEMBL28915354 | 0.88 | ROCK2 (0.44) | ROCK2ROCK1THRBNPC1MEN1 | |
| SCHEMBL23501411 | 0.88 | ROCK2 (0.43) | ROCK2ROCK1GAAMEN1KMT2A | |
| SCHEMBL23927564 | 0.88 | ROCK2 (0.43) | ROCK2ROCK1NAMPT | |
| SCHEMBL23927567 | 0.88 | ROCK2 (0.43) | ROCK2ROCK1NAMPT | |
| SCHEMBL23927702 | 0.88 | ROCK2 (0.37) | ROCK2ROCK1GAANAMPTMEN1 | |
| SCHEMBL23501294 | 0.88 | ALDH1A1 (0.39) | ROCK2ROCK1GAAHDAC1HDAC7 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111217834-B | Nitroxide derivatives of ROCK kinase inhibitors | 维眸生物科技（上海）有限公司 | 2021-10-26 | — | — | CN | disclosed |
| CN-111217834-A | Nitroxide derivatives of ROCK kinase inhibitors | 维眸生物科技（上海）有限公司 | 2020-06-02 | — | — | CN | disclosed |