Nitric Acid

Nitric Acid

SCHEMBL9874458

O=[N+]([O-])O.OCCOC(c1ccccc1)c1ccccc1

nearest known ligand 0.50

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
GSR P00390 1/20 0.47
SCN1A P35498 3/20 0.46
SCN2A Q99250 3/20 0.46
SCN3A Q9NY46 3/20 0.46
SLC6A4 P31645 3/20 0.46
SLC6A3 Q01959 3/20 0.46
LMNA P02545 2/20 0.46
ADRA1A P35348 2/20 0.46
HTT P42858 2/20 0.46
CYP1A2 P05177 1/20 0.46
CHRM2 P08172 1/20 0.46
CHRM4 P08173 1/20 0.46
CHRM5 P08912 1/20 0.46
ADRA2A P08913 1/20 0.46
CYP2D6 P10635 1/20 0.46
CHRM1 P11229 1/20 0.46
TSHR P16473 1/20 0.46
ADRA2B P18089 1/20 0.46
CHRM3 P20309 1/20 0.46
SLC6A2 P23975 1/20 0.46

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
SCHEMBL4556683 0.87 SCN1A (0.57) SCN1ASCN2ASCN3ASLC6A4SLC6A3
SCHEMBL9874449 0.77 PTGS1 (0.49) GSRSCN1ASCN2ASCN3ASLC6A4
SCHEMBL14160113 0.77 SCN1A (0.51) SCN1ASCN2ASCN3ASLC6A4SLC6A3
SCHEMBL5411041 0.77 SCN1A (0.50) SCN1ASCN2ASCN3ASLC6A4SLC6A3
SCHEMBL4667514 0.76 SCN1A (0.53) SCN1ASCN2ASCN3ASLC6A4SLC6A3
SCHEMBL4669215 0.75 ACP3 (0.50) SCN1ASCN2ASCN3ASLC6A4SLC6A3
SCHEMBL4667564 0.74 SCN1A (0.65) SCN1ASCN2ASCN3ASLC6A4SLC6A3
SCHEMBL4669156 0.74 SCN1A (0.52) SCN1ASCN2ASCN3ASLC6A4SLC6A3
Nitric Acid SCHEMBL9875712 0.74 GSR (0.49) GSRHTR2AHRH1MEN1KMT2A
Nitric Acid SCHEMBL9874855 0.74 GSR (0.56) GSRLMNAHTTCYP2D6HTR2A

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
US-5049694-A Cardiovascular disorders CEDONA PHARMACEUTICALS B.V. (NL) 1991-09-17 US disclosed
EP-0359335-A2 Pharmaceutical composition having relaxing activity which contains a nitrate ester as active substance CEDONA PHARMACEUTICALS B.V. (NL) 1990-03-21 EP disclosed