Nitric Acid

Nitric Acid

SCHEMBL163518

ClCN1CCc2ccccc2CC1.O=[N+]([O-])O

nearest known ligand 0.45

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
HDAC1 Q13547 2/20 0.43
HDAC6 Q9UBN7 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
RAB9A P51151 1/20 0.42
ALDH1A1 P00352 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HPGD P15428 3/20 0.41
HDAC3 O15379 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
NCOR2 Q9Y618 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C19 P33261 1/20 0.40
HTR1A P08908 1/20 0.40
DRD2 P14416 1/20 0.40

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
SCHEMBL162670 0.85 MAOA (0.46) HDAC1HDAC6MEN1KMT2AALDH1A1
Bromide SCHEMBL161201 0.83 MAOA (0.45) HDAC1HDAC6ALDH1A1DRD2HTR7
Iodide SCHEMBL162027 0.83 MAOA (0.45) HDAC1HDAC6MEN1KMT2AALDH1A1
Phosphoric Acid SCHEMBL166017 0.82 HDAC1 (0.49) HDAC1HDAC6MEN1KMT2ASMN1; SMN2
Sulfuric Acid SCHEMBL158676 0.82 HSD17B10 (0.49) HDAC1HDAC6MEN1KMT2AALDH1A1
SCHEMBL158570 0.79 HDAC1 (0.47) HDAC1HDAC6MEN1KMT2AHDAC3
Succinic Acid SCHEMBL161277 0.79 NOTUM (0.54) HDAC1HDAC6MEN1KMT2AALDH1A1
Malonic Acid SCHEMBL160931 0.79 HDAC1 (0.50) HDAC1HDAC6MEN1KMT2AMAPT
Fumaric Acid SCHEMBL159723 0.78 MEN1 (0.46) HDAC1HDAC6MEN1KMT2AMAPT
Maleic Acid SCHEMBL161823 0.78 MEN1 (0.46) HDAC1HDAC6MEN1KMT2AMAPT

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
WO-2012030953-A1 5-HT2C RECEPTOR AGONISTS IN THE TREATMENT OF DISORDERS AMELIORATED BY REDUCTION OF NOREPINEPHRINE LEVEL ARENA PHARMACEUTICALS, INC. (US) 2012-03-08 WO disclosed