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 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA5A | P35218 | 1/20 | 0.40 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CSF1R | P07333 | 1/20 | 0.32 |
| ▸ | TYMP | P19971 | 2/20 | 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 | |
|---|---|---|---|---|
| Nitric Acid SCHEMBL8957431 | 0.89 | HPGD (0.37) | CA5ACA5BESR2ALDH1A1TDP1 | |
| SCHEMBL5733 | 0.81 | — | — | |
| SCHEMBL24197652 | 0.81 | ESR2 (0.50) | ESR2BRD4TYMP | |
| SCHEMBL240852 | 0.81 | ESR2 (0.50) | ESR2BRD4TYMP | |
| Nitric Acid SCHEMBL9874935 | 0.79 | CA5A (0.44) | CA5ACA5BESR2ALDH1A1TDP1 | |
| Nitric Acid SCHEMBL9766393 | 0.73 | EPHX1 (0.36) | CA5ACA5BALDH1A1TDP1 | |
| SCHEMBL899402 | 0.73 | ESR2 (0.45) | ESR2BRD4 | |
| SCHEMBL21110513 | 0.73 | ESR2 (0.45) | ESR2BRD4TYMP | |
| SCHEMBL760537 | 0.73 | ESR2 (0.45) | ESR2BRD4TYMP | |
| SCHEMBL15842184 | 0.73 | ESR2 (0.53) | ESR2BRD4TYMP |
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 |
|---|---|---|---|---|---|---|---|
| EP-0689435-A1 | USE OF SUBSTITUTED ALKYL NITRATES FOR THE TREATMENT OF PATHOLOGICALLY INCREASED INTRA-OCULAR PRESSURE | BYK NEDERLAND BV (NL) | 1996-01-03 | — | — | EP | claimed |
| WO-1994021248-A1 | USE OF SUBSTITUTED ALKYL NITRATES FOR THE TREATMENT OF PATHOLOGICALLY INCREASED INTRA-OCULAR PRESSURE | BYK NEDERLAND BV (NL) | 1994-09-29 | — | — | WO | claimed |