Nitric Acid

Nitric Acid

SCHEMBL11117097

CC(CO)(CO)CO.O=[N+]([O-])O

nearest known ligand 0.47

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 0.47
CA5B Q9Y2D0 1/20 0.47
LMNA P02545 1/20 0.42
ALDH1A1 P00352 3/20 0.36
TDP1 Q9NUW8 1/20 0.35
TSHR P16473 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
Nitric Acid SCHEMBL28389404 1.00 CA5A (0.47) CA5ACA5BLMNAALDH1A1TDP1
Nitric Acid SCHEMBL442180 1.00 CA5A (0.47) CA5ACA5BLMNAALDH1A1TDP1
Methacrylic Acid SCHEMBL27588163 0.82 CA5A (0.32) CA5ACA5BLMNA
Nitric Acid SCHEMBL6858001 0.82 CA5A (0.32) CA5ACA5BLMNA
Nitric Acid SCHEMBL5538160 0.82 CA5A (0.47) CA5ACA5BLMNAALDH1A1TDP1
SCHEMBL1079284 0.81 LMNA (0.42) LMNAALDH1A1TDP1TSHR
Deanol SCHEMBL11140865 0.80 CA5A (0.44) CA5ACA5BLMNAALDH1A1TDP1
Nitric Acid SCHEMBL8606303 0.79 CA5A (0.33) CA5ACA5BLMNA
Nitric Acid SCHEMBL10587822 0.79 ALDH1A1 (0.48) CA5ACA5BLMNAALDH1A1
SCHEMBL18403612 0.78 LMNA (0.39) LMNAALDH1A1TDP1TSHR

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-4457791-A N,N'-DIMETHYL METHYLENE DINITRAMINE THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1984-07-03 US disclosed