Nitric Acid

Nitric Acid

SCHEMBL9872373

O=[N+]([O-])O.OCCc1ccsc1

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 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.47
TAAR1 Q96RJ0 1/20 0.47
DRD2 P14416 1/20 0.40
DRD3 P35462 1/20 0.40
GRM2 Q14416 1/20 0.36
GRM3 Q14832 1/20 0.36
CA2 P00918 2/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA4 P22748 1/20 0.35
CA6 P23280 1/20 0.35
CA5A P35218 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 1/20 0.35
CA14 Q9ULX7 1/20 0.35
CA5B Q9Y2D0 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
SLC1A3 P43003 2/20 0.34
SLC1A2 P43004 2/20 0.34
SLC1A1 P43005 2/20 0.34

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
SCHEMBL28110 0.86
Charcoal, Activated SCHEMBL30972333 0.84
SCHEMBL27421011 0.84
SCHEMBL7139921 0.78 TAAR1 (0.47) TAAR1DRD2DRD3GRM2GRM3
SCHEMBL1312020 0.74
SCHEMBL8957357 0.73 TAAR1 (0.46) TAAR1DRD2DRD3CA2CA12
Phenylethyl Alcohol SCHEMBL9874433 0.72 TDP1 (0.70) TSHRTAAR1CA2CA12CA1
SCHEMBL2782138 0.71 TAAR1 (0.52) TAAR1DRD2DRD3GRM2GRM3
SCHEMBL1309931 0.71 TAAR1 (0.52) TAAR1DRD2DRD3GRM2GRM3
SCHEMBL31115246 0.71 TAAR1 (0.52) TAAR1DRD2DRD3GRM2GRM3

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