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 | |
|---|---|---|---|---|
| ▸ | GABRP | O00591 | 2/20 | 0.40 |
| ▸ | GABRD | O14764 | 2/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.40 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.40 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.40 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.40 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.40 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.40 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.40 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.40 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.40 |
| ▸ | GABRE | P78334 | 2/20 | 0.40 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.40 |
| ▸ | GABRG1 | Q8N1C3 | 2/20 | 0.40 |
| ▸ | GABRG3 | Q99928 | 2/20 | 0.40 |
| ▸ | GABRQ | Q9UN88 | 2/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL351540 | 0.91 | GABRP (0.46) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL3086345 | 0.89 | GABRP (0.45) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL3086351 | 0.89 | GABRP (0.45) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| Nitric Acid SCHEMBL7048263 | 0.85 | KDM4E (0.34) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| Nitric Acid SCHEMBL7047310 | 0.85 | KDM4E (0.34) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| Nitric Acid SCHEMBL7052214 | 0.84 | PKM (0.37) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL29619789 | 0.81 | DHODH (0.44) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL28965796 | 0.81 | DHODH (0.44) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL9632787 | 0.81 | GABRP (0.44) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL9630611 | 0.80 | GABRP (0.42) | GABRPGABRDGABRA1GABRB1GABRG2 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0601288-B1 | Substituted 2,3-dicarboxypyridinium nitrates | BASF AG (DE) | 2003-05-02 | — | — | EP | claimed |
| EP-0601288-A2 | Substituted 2,3-dicarboxypyridinium nitrates | AMERICAN CYANAMID COMPANY (US) | 1994-06-15 | — | — | EP | claimed |
| US-5284955-A | Herbicide intermediates | AMERICAN CYANAMID COMPANY (US) | 1994-02-08 | — | — | US | claimed |
| JP-6234743-A | — | — | None | — | — | JP | disclosed |
| EP-0601288-B1 | Substituted 2,3-dicarboxypyridinium nitrates | BASF AG (DE) | 2003-05-02 | — | — | EP | disclosed |
| US-5410062-A | Heating substituted quinoline with nitric acid in presence of manganese catalyst, concentrating in presence of nitroaromatic solvent | AMERICAN CYANAMID COMPANY (US) | 1995-04-25 | — | — | US | disclosed |
| JP-H06234743-A | SUBSTITUTED 2,3-DICARBOXYPYRIDINIUM NITRATE | AMERICAN CYANAMID CO | 1994-08-23 | — | — | JP | disclosed |
| EP-0601288-A2 | Substituted 2,3-dicarboxypyridinium nitrates | AMERICAN CYANAMID COMPANY (US) | 1994-06-15 | — | — | EP | disclosed |
| US-5284955-A | Herbicide intermediates | AMERICAN CYANAMID COMPANY (US) | 1994-02-08 | — | — | US | disclosed |