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 | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | METAP1 | P53582 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | CA5A | P35218 | 1/20 | 0.35 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | GSR | P00390 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| Nitric Acid SCHEMBL8957391 | 0.89 | CA5A (0.40) | ESR2CA5ACA5BALDH1A1TDP1 | |
| SCHEMBL16091690 | 0.83 | CYP1A2 (0.48) | HPGDCYP1A2METAP1ESR2EPHX1 | |
| Cyclohexane SCHEMBL12482977 | 0.83 | CYP1A2 (0.48) | HPGDCYP1A2METAP1ESR2EPHX1 | |
| SCHEMBL2532505 | 0.83 | CYP1A2 (0.48) | HPGDCYP1A2METAP1ESR2EPHX1 | |
| SCHEMBL21471 | 0.83 | — | — | |
| SCHEMBL25310751 | 0.83 | CYP1A2 (0.48) | HPGDCYP1A2METAP1ESR2EPHX1 | |
| SCHEMBL2018398 | 0.83 | CYP1A2 (0.48) | HPGDCYP1A2METAP1ESR2EPHX1 | |
| SCHEMBL3340061 | 0.83 | CYP1A2 (0.48) | HPGDCYP1A2METAP1ESR2EPHX1 | |
| SCHEMBL1240639 | 0.83 | CYP1A2 (0.48) | HPGDCYP1A2METAP1ESR2EPHX1 | |
| Nitric Acid SCHEMBL8957413 | 0.82 | CA5A (0.38) | HPGDESR2EPHX1CA5ACA5B |
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 | disclosed |
| 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 | disclosed |