Nitric Acid

Nitric Acid

SCHEMBL7147205

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

nearest known ligand 0.80

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 9)

geneUniProtsupporting neighboursconfidence
CA5A P35218 1/20 0.80
CA5B Q9Y2D0 1/20 0.80
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
ALDH1A1 P00352 3/20 0.33
TSHR P16473 3/20 0.33
TDP1 Q9NUW8 2/20 0.33
HPGD P15428 1/20 0.31
HIF1A Q16665 1/20 0.31

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 SCHEMBL719744 1.00
Nitric Acid SCHEMBL355269 1.00 CA5A (0.80) CA5ACA5BMEN1KMT2AALDH1A1
Nitric Acid SCHEMBL8718140 1.00 CA5A (0.80) CA5ACA5BMEN1KMT2AALDH1A1
Nitric Acid SCHEMBL7147203 0.95 CA5A (0.73) CA5ACA5BMEN1KMT2AALDH1A1
Nitric Acid SCHEMBL1943526 0.95
Nitric Acid SCHEMBL21523563 0.95 CA5A (0.89) CA5ACA5BMEN1KMT2AALDH1A1
Nitric Acid SCHEMBL479716 0.95
Nitric Acid SCHEMBL19616567 0.95 CA5A (0.89) CA5ACA5BMEN1KMT2AALDH1A1
Nitric Acid SCHEMBL194087 0.95
Nitric Acid SCHEMBL228897 0.95 CA5A (0.89) CA5ACA5BMEN1KMT2AALDH1A1

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
US-6649789-B2 From acetic acid, ethylene and oxygen or oxygen-containing gases; catalyst selectivity CELANESE CHEMICALS EUROPE GMBH (DE) 2003-11-18 US disclosed
US-6579824-B1 Selectivity for vinyl acetate CELANESE CHEMICALS EUROPE GMBH (DE) 2003-06-17 US disclosed
US-20020198404-A1 Catalyst based on palladium, gold, alkali metal and lanthanoid and process for preparing vinyl acetate CELANESE CHEMICALS EUROPE GMBH 2002-12-26 US disclosed