Nitric Acid

Nitric Acid

SCHEMBL11267951

COc1ccc(C(O)(Cc2ccccc2Cl)Cn2ccnc2)cc1.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
HSP90AA1 P07900 1/20 0.45
CYP19A1 P11511 5/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
MAPK1 P28482 4/20 0.38
TP53 P04637 2/20 0.38
MAPT P10636 4/20 0.38
ALDH1A1 P00352 4/20 0.38
TSHR P16473 1/20 0.38
MEN1 O00255 2/20 0.37
GAA P10253 2/20 0.37
KMT2A Q03164 2/20 0.37
USP2 O75604 2/20 0.37
LMNA P02545 2/20 0.37
CYP3A4 P08684 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
ALPL P05186 1/20 0.37
HTT P42858 1/20 0.37
RECQL P46063 1/20 0.37
HIF1A Q16665 1/20 0.37
NPSR1 Q6W5P4 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
Nitric Acid SCHEMBL11278708 0.90 HSP90AA1 (0.43) HSP90AA1CYP19A1L3MBTL1MAPK1TP53
Nitric Acid SCHEMBL11268175 0.89 HSP90AA1 (0.53) HSP90AA1CYP19A1L3MBTL1MAPK1TP53
Nitric Acid SCHEMBL11269480 0.89 CYP3A4 (0.50) HSP90AA1CYP19A1L3MBTL1MAPK1TP53
Nitric Acid SCHEMBL11268541 0.85 CYP19A1 (0.47) HSP90AA1CYP19A1L3MBTL1MAPK1TP53
Nitric Acid SCHEMBL11266033 0.84 CYP19A1 (0.44) HSP90AA1CYP19A1L3MBTL1MAPK1TP53
SCHEMBL11267955 0.83 HSP90AA1 (0.39) HSP90AA1CYP19A1L3MBTL1MAPK1MAPT
SCHEMBL11257995 0.81 CYP11B1 (0.54) HSP90AA1CYP19A1L3MBTL1MAPK1TP53
Nitric Acid SCHEMBL11269538 0.80 CYP3A4 (0.52) HSP90AA1CYP19A1L3MBTL1MAPK1TP53
Nitric Acid SCHEMBL11263590 0.79 HSP90AA1 (0.53) HSP90AA1CYP19A1L3MBTL1MAPK1TP53
Nitric Acid SCHEMBL11268604 0.79 OGG1 (0.48) HSP90AA1L3MBTL1MAPK1TP53MAPT

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
US-4358458-A BACTERICIDE, FUNGICIDES NORDMARK-WERKE GMBH (DE) 1982-11-09 US disclosed