Nitric Acid

Nitric Acid

SCHEMBL11056005

NCC(N)N.O=[N+]([O-])O.O=[N+]([O-])O.O=[N+]([O-])O

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 6)

geneUniProtsupporting neighboursconfidence
CA5A P35218 1/20 0.50
CA5B Q9Y2D0 1/20 0.50
ANPEP P15144 1/20 0.33
ERAP2 Q6P179 1/20 0.33
ALDH1A1 P00352 2/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
Nitric Acid SCHEMBL29244059 0.82 ALDH1A1 (0.56) CA5ACA5BANPEPERAP2ALDH1A1
Nitric Acid SCHEMBL28858089 0.82 ALDH1A1 (0.56) CA5ACA5BANPEPERAP2ALDH1A1
Nitric Acid SCHEMBL7914060 0.81
Nitric Acid SCHEMBL11327425 0.79 CA5A (0.67) CA5ACA5BALDH1A1TDP1
Nitric Acid SCHEMBL23270365 0.79
Nitric Acid SCHEMBL29242395 0.79 CA5A (0.47) CA5ACA5B
Nitric Acid SCHEMBL29270163 0.79
Nitric Acid SCHEMBL10579131 0.77
Ethylenediamine SCHEMBL721753 0.76 CA5A (0.61) CA5ACA5BALDH1A1TDP1
Ethylenediamine SCHEMBL6232364 0.76 CA5A (0.61) CA5ACA5BALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4481048-A AMMONIUM NITRATE AND DIETHYLENETRIAMINE TRINITRATE THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITED STATES DEPARTMENT OF ENERGY (US) 1984-11-06 US disclosed