Nitric Acid

Nitric Acid

SCHEMBL11289809

CC(C)(C)c1nccn1CC(O)c1ccc(Cl)cc1Cl.O=[N+]([O-])O

nearest known ligand 0.50

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
HIF1A Q16665 4/20 0.50
TSHR P16473 2/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C19 P33261 1/20 0.50
ADRA2C P18825 1/20 0.46
KCNH2 Q12809 8/20 0.46
MEN1 O00255 3/20 0.43
USP2 O75604 3/20 0.43
LMNA P02545 3/20 0.43
TP53 P04637 3/20 0.43
CYP3A4 P08684 3/20 0.43
MAPT P10636 3/20 0.43
MAPK1 P28482 3/20 0.43
HTT P42858 3/20 0.43
KMT2A Q03164 3/20 0.43
NPSR1 Q6W5P4 3/20 0.43
TDP1 Q9NUW8 3/20 0.43
HSP90AA1 P07900 3/20 0.43
ALPL P05186 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43

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
Hydrochloric Acid SCHEMBL11260137 0.70 KCNH2 (0.57) ADRA2CKCNH2
Nitric Acid SCHEMBL10833077 0.70 ADRA2C (0.51) HIF1ATSHRADRA2CKCNH2MEN1
Nitric Acid SCHEMBL10469484 0.65 HIF1A (0.40) HIF1ATSHRCYP2D6CYP2C19MEN1
Nitric Acid SCHEMBL11847913 0.65 CYP3A4 (0.64) HIF1ATSHRCYP2D6CYP2C19ADRA2C
SCHEMBL6213236 0.65 KCNH2 (0.47) HIF1ATSHRCYP2D6CYP2C19ADRA2C
Nitric Acid SCHEMBL10469482 0.65 CYP3A4 (0.46) HIF1ATSHRCYP2D6CYP2C19ADRA2C
SCHEMBL4817509 0.64 ADRA2C (1.00) HIF1ATSHRCYP2D6CYP2C19ADRA2C
SCHEMBL4664253 0.64 ADRA2C (1.00) HIF1ATSHRCYP2D6CYP2C19ADRA2C
SCHEMBL4664843 0.64 ADRA2C (1.00) HIF1ATSHRCYP2D6CYP2C19ADRA2C
SCHEMBL29846165 0.64 ADRA2C (1.00) HIF1ATSHRCYP2D6CYP2C19ADRA2C

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
EP-0049913-A2 New ethenylimidazole derivatives, processes for their preparation and pharmaceutical compositions containing them; intermediates, useful in their preparation and a process for the preparation thereof GIST-BROCADES N.V. (NL) 1982-04-21 EP disclosed