Nitric Acid

Nitric Acid

SCHEMBL9874855

O=[N+]([O-])O.OCC(c1ccccc1)c1ccccc1

nearest known ligand 0.56

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
GSR P00390 1/20 0.56
NPC1 O15118 2/20 0.41
ADAM17 P78536 1/20 0.41
CNR1 P21554 2/20 0.40
CNR2 P34972 2/20 0.40
TRPA1 O75762 2/20 0.39
ALDH1A1 P00352 2/20 0.39
HTR2A P28223 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
LMNA P02545 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
CYP2D6 P10635 1/20 0.38
SRC P12931 1/20 0.38
CPA1 P15085 3/20 0.38
ACP3 P15309 1/20 0.38
POLB P06746 1/20 0.37
TP53 P04637 1/20 0.37
GAA P10253 1/20 0.37
HTT P42858 1/20 0.37

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
SCHEMBL15617595 0.84 CNR1 (0.56) GSRCNR1CNR2ALDH1A1LMNA
Nitric Acid SCHEMBL9803283 0.83 GSR (0.53) GSRNPC1ALDH1A1LMNAMEN1
Nitric Acid SCHEMBL9875712 0.83 GSR (0.49) GSRNPC1ADAM17CNR1CNR2
SCHEMBL193835 0.83 HTR2A (0.52) GSRTRPA1HTR2ATAAR1LMNA
Nitric Acid SCHEMBL9872245 0.82 GSR (0.51) GSRNPC1ADAM17TRPA1ALDH1A1
Hydrochloric Acid SCHEMBL6251948 0.81 HTR2A (0.50) GSRTRPA1HTR2ATAAR1LMNA
Ammonia Solution, Strong SCHEMBL28352255 0.81 HTR2A (0.50) GSRTRPA1HTR2ATAAR1LMNA
SCHEMBL16396156 0.80 ACP3 (0.59) ALDH1A1LMNAMEN1KMT2AACP3
Nitric Acid SCHEMBL9838314 0.77 ALDH1A1 (0.47) GSRALDH1A1HTR2ALMNAMEN1
Acetic Acid SCHEMBL28538311 0.77 MTNR1A (0.52) TRPA1HTR2ALMNAKMT2ACYP2D6

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