Nitric Acid

Nitric Acid

SCHEMBL9873739

O=[N+]([O-])O.OC(COCc1ccccc1)COCc1ccccc1

nearest known ligand 0.65

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 18)

geneUniProtsupporting neighboursconfidence
CA1 P00915 5/20 0.65
CA2 P00918 3/20 0.62
CA7 P43166 3/20 0.62
CA9 Q16790 3/20 0.62
MAPK1 P28482 1/20 0.54
CA4 P22748 1/20 0.53
TSHR P16473 2/20 0.48
POLB P06746 1/20 0.46
PRMT5 O14744 1/20 0.46
WDR77 Q9BQA1 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
AGER Q15109 1/20 0.46
SLC1A1 P43005 1/20 0.45
TACR1 P25103 2/20 0.44

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
SCHEMBL397022 0.87 CA1 (0.78) CA1CA2CA7CA9MAPK1
SCHEMBL12601486 0.83 CA1 (0.56) CA1CA2CA7CA9MAPK1
SCHEMBL7153591 0.80 CA1 (0.76) CA1CA2CA7CA9MAPK1
SCHEMBL9661261 0.79 CA1 (0.66) CA1CA2CA7CA9MAPK1
SCHEMBL5333780 0.79 CA1 (0.66) CA1CA2CA7CA9MAPK1
SCHEMBL15764380 0.79 CA1 (0.66) CA1CA2CA7CA9MAPK1
SCHEMBL23258692 0.78 CA1 (0.70) CA1CA2CA7CA9MAPK1
SCHEMBL508126 0.78 CA1 (0.70) CA1CA2CA7CA9MAPK1
SCHEMBL16269805 0.78 CA1 (0.70) CA1CA2CA7CA9MAPK1
SCHEMBL122306 0.78 CA1 (0.70) CA1CA2CA7CA9MAPK1

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