Nitric Acid

Nitric Acid

SCHEMBL7764393

CCCCCCCCCCCC(C)N(Cc1ccccc1CN(C(C)CCCCCCCCCCC)C(C)CCCCCCCCCCC)C(C)CCCCCCCCCCC.O=[N+]([O-])O.O=[N+]([O-])O

nearest known ligand 0.37

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
CSNK1E P49674 1/20 0.37
ALDH1A1 P00352 1/20 0.36
CYSLTR2 Q9NS75 2/20 0.36
CYSLTR1 Q9Y271 2/20 0.36
LIPG Q9Y5X9 1/20 0.36
PRSS1 P07477 1/20 0.35
PRSS2 P07478 1/20 0.35
PRSS3 P35030 1/20 0.35
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34
HSP90AA1 P07900 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
PSEN1 P49768 1/20 0.33
PSEN2 P49810 1/20 0.33
APH1B Q8WW43 1/20 0.33
NCSTN Q92542 1/20 0.33
APH1A Q96BI3 1/20 0.33
PSENEN Q9NZ42 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.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL7760971 0.87 CSNK1E (0.40) CSNK1EALDH1A1CYSLTR2CYSLTR1LIPG
Hydrochloric Acid SCHEMBL8720793 0.87 CSNK1E (0.40) CSNK1EALDH1A1CYSLTR2CYSLTR1LIPG
Hydrochloric Acid SCHEMBL7764448 0.87 CSNK1E (0.40) CSNK1EALDH1A1CYSLTR2CYSLTR1LIPG
Sulfuric Acid SCHEMBL7765900 0.86 TP53 (0.44) CSNK1EALDH1A1CYSLTR2CYSLTR1LIPG
Acetic Acid SCHEMBL7764520 0.86 ALDH1A1 (0.44) CSNK1EALDH1A1CYSLTR2CYSLTR1PRSS1
Succinic Acid SCHEMBL7764851 0.83 CYSLTR2 (0.50) ALDH1A1CYSLTR2CYSLTR1CES2CES1
Malonic Acid SCHEMBL7763542 0.83 CYSLTR2 (0.44) CSNK1EALDH1A1CYSLTR2CYSLTR1CNR2
Lactic Acid SCHEMBL7768244 0.83 CSNK1E (0.43) CSNK1EALDH1A1CYSLTR2CYSLTR1CNR2
Adipic Acid SCHEMBL7765945 0.82 CYSLTR2 (0.52) ALDH1A1CYSLTR2CYSLTR1MEN1KMT2A
Cadaverine Tartrate SCHEMBL7764354 0.82 CSNK1E (0.42) CSNK1EALDH1A1CYSLTR2CYSLTR1CNR2

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0825175-B1 Quaternary ammonium disinfectant NICCA CHEMICAL CO (JP) 2001-06-13 EP disclosed
EP-0825175-A1 Quaternary ammonium disinfectant NICCA CHEMICAL CO., LTD. (JP) 1998-02-25 EP disclosed