Nitric Acid

Nitric Acid

SCHEMBL7051650

Cc1cnc(C(=O)O)c(C(=O)O)c1.O=[N+]([O-])O

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ERG11

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)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.38
POLB P06746 2/20 0.38
GABRP O00591 1/20 0.38
GABRD O14764 1/20 0.38
GABRA1 P14867 1/20 0.38
GABRB1 P18505 1/20 0.38
GABRG2 P18507 1/20 0.38
GABRB3 P28472 1/20 0.38
GABRA5 P31644 1/20 0.38
GABRA3 P34903 1/20 0.38
GABRA2 P47869 1/20 0.38
GABRB2 P47870 1/20 0.38
GABRA4 P48169 1/20 0.38
GABRE P78334 1/20 0.38
GABRA6 Q16445 1/20 0.38
GABRG1 Q8N1C3 1/20 0.38
GABRG3 Q99928 1/20 0.38
GABRQ Q9UN88 1/20 0.38
KDM4E B2RXH2 6/20 0.37
ALDH1A1 P00352 4/20 0.37

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL1819716 0.89 GABRP (0.44) L3MBTL1GABRPGABRDGABRA1GABRB1
SCHEMBL30968742 0.89 GABRP (0.44) L3MBTL1GABRPGABRDGABRA1GABRB1
SCHEMBL28276724 0.88 GABRP (0.43) L3MBTL1GABRPGABRDGABRA1GABRB1
Nitric Acid SCHEMBL7049249 0.80 GABRP (0.40) L3MBTL1POLBGABRPGABRDGABRA1
SCHEMBL2487071 0.78 ATM (0.46) L3MBTL1GABRPGABRDGABRA1GABRB1
SCHEMBL29619749 0.78 ATM (0.46) L3MBTL1GABRPGABRDGABRA1GABRB1
SCHEMBL10574606 0.78 GABRP (0.36) L3MBTL1GABRPGABRDGABRA1GABRB1
Nitric Acid SCHEMBL7048263 0.76 KDM4E (0.34) L3MBTL1POLBGABRPGABRDGABRA1
Nitric Acid SCHEMBL7047310 0.76 KDM4E (0.34) L3MBTL1POLBGABRPGABRDGABRA1
Nitric Acid SCHEMBL7052214 0.76 PKM (0.37) L3MBTL1POLBGABRPGABRDGABRA1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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