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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | CA5A | P35218 | 1/20 | 0.47 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.47 |
| ▸ | GSR | P00390 | 3/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 6/20 | 0.31 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | ADH1B | P00325 | 1/20 | 0.31 |
| ▸ | ADH1C | P00326 | 1/20 | 0.31 |
| ▸ | ADH1A | P07327 | 1/20 | 0.31 |
| ▸ | ADH4 | P08319 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 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 | |
|---|---|---|---|---|
| Biphenyl SCHEMBL596513 | 0.97 | ALDH1A1 (0.44) | ALDH1A1CA5ACA5BGSRCES2 | |
| Nitric Acid SCHEMBL11228157 | 0.97 | ALDH1A1 (0.50) | ALDH1A1CA5ACA5BGSRCES2 | |
| Cyclohexane SCHEMBL8006197 | 0.80 | CA5A (0.73) | ALDH1A1CA5ACA5BGSRMEN1 | |
| Cyclohexane SCHEMBL2019979 | 0.80 | CA5A (0.73) | ALDH1A1CA5ACA5BGSRMEN1 | |
| Cyclohexanol SCHEMBL9019597 | 0.80 | TSHR (0.56) | CA5ACA5BGSRCES2CES1 | |
| Cyclohexanol SCHEMBL9019499 | 0.80 | TSHR (0.56) | CA5ACA5BGSRCES2CES1 | |
| Cyclohexylamine SCHEMBL831197 | 0.78 | CA5A (0.42) | ALDH1A1CA5ACA5BGSRCES2 | |
| Cyclohexylamine SCHEMBL6383974 | 0.78 | CA5A (0.42) | ALDH1A1CA5ACA5BGSRCES2 | |
| Nitric Acid SCHEMBL9803591 | 0.77 | GSR (0.54) | CA5ACA5BGSRSLC18A3MEN1 | |
| Nitric Acid SCHEMBL9874582 | 0.77 | GSR (0.54) | CA5ACA5BGSRSLC18A3MEN1 |
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-2199294-A1 | New stereospecific method for the preparation of dioxa bicyclooctane nitrate compounds | LACER, S.A. (ES) | 2010-06-23 | — | — | EP | disclosed |