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 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 4/20 | 0.42 |
| ▸ | AXL | P30530 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | P4HB | P07237 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 7/20 | 0.34 |
| ▸ | TDO2 | P48775 | 5/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.33 |
| ▸ | METAP2 | P50579 | 1/20 | 0.33 |
| ▸ | PDK1 | Q15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL21271929 | 0.73 | NOS1 (0.61) | NOS1AXLMAPTPOLBMAOB | |
| SCHEMBL22281317 | 0.71 | TRPA1 (0.42) | NOS1AXLTRPA1IDO1CDK2 | |
| SCHEMBL16746127 | 0.71 | TRPA1 (0.42) | NOS1AXLTRPA1IDO1CDK2 | |
| SCHEMBL20618762 | 0.69 | TRPA1 (0.44) | NOS1AXLP4HBTRPA1IDO1 | |
| SCHEMBL14803988 | 0.69 | NOS1 (0.46) | NOS1AXLTRPA1IDO1CDK2 | |
| SCHEMBL61091 | 0.69 | TRPA1 (0.38) | NOS1AXLTRPA1IDO1CCNA2 | |
| SCHEMBL10282903 | 0.69 | TRPA1 (0.38) | NOS1AXLMAPTTRPA1IDO1 | |
| SCHEMBL21341312 | 0.68 | TRPA1 (0.40) | NOS1AXLTRPA1IDO1CCNA2 | |
| SCHEMBL24944422 | 0.67 | BRD4 (0.44) | NOS1AXLTRPA1IDO1CDK2 | |
| SCHEMBL1965090 | 0.67 | NOS1 (0.53) | NOS1AXLMAPTPOLBMAOB |
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-1565452-A2 | 3-SUBSTITUTED-6-ARYL PYRIDINES AS LIGANDS OF C5A RECEPTORS | NEUROGEN CORPORATION (US) | 2005-08-24 | — | — | EP | disclosed |
| WO-2004043925-A2 | 3-SUBSTITUTED-6-ARYL PYRIDINED AS LIGANDS OF C5A RECEPTORS | NEUROGEN CORPORATION (US) | 2004-05-27 | — | — | WO | disclosed |