Nitric Acid

Nitric Acid

SCHEMBL7366281

N=C(N)NC(=N)Nc1ccc(Cl)c(Cl)c1.O=[N+]([O-])O

nearest known ligand 0.46

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
EPHX1 P07099 2/20 0.46
EPHX2 P34913 2/20 0.46
GAA P10253 1/20 0.44
ALDH1A1 P00352 3/20 0.43
IDO1 P14902 2/20 0.43
CA2 P00918 1/20 0.43
CA4 P22748 1/20 0.43
CA5A P35218 1/20 0.43
CA9 Q16790 1/20 0.43
MAPK14 Q16539 1/20 0.43
MAPT P10636 4/20 0.43
ALOX15 P16050 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
HSD17B10 Q99714 1/20 0.43
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
NPC1 O15118 2/20 0.42
LMNA P02545 2/20 0.42
HTT P42858 2/20 0.42
KDM4E B2RXH2 1/20 0.42

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
SCHEMBL891282 0.89 EPHX1 (0.52) EPHX1EPHX2GAAALDH1A1IDO1
Nitric Acid SCHEMBL4490937 0.88 EPHX1 (0.51) EPHX1EPHX2GAAALDH1A1IDO1
Hydrochloric Acid SCHEMBL9668292 0.88 EPHX1 (0.50) EPHX1EPHX2GAAALDH1A1IDO1
SCHEMBL4100753 0.80 EPHX1 (0.58) EPHX1EPHX2GAAALDH1A1IDO1
SCHEMBL13584612 0.79 EPHX1 (0.59) EPHX1EPHX2GAAALDH1A1IDO1
SCHEMBL29518499 0.79 EPHX1 (0.59) EPHX1EPHX2GAAALDH1A1IDO1
SCHEMBL10383506 0.79 EPHX1 (0.51) EPHX1EPHX2GAAALDH1A1CA2
Hydrochloric Acid SCHEMBL13584366 0.78 EPHX1 (0.57) EPHX1EPHX2GAAALDH1A1IDO1
SCHEMBL11139315 0.77 EPHX1 (0.68) EPHX1EPHX2GAAALDH1A1IDO1
SCHEMBL1995869 0.76 EPHX1 (0.59) EPHX1EPHX2GAAALDH1A1IDO1

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
WO-1992008464-A1 SUBSTITUTED UREA AND RELATED CELL ADHESION MODULATION COMPOUNDS TANABE SEIYAKU CO. LTD. (JP) 1992-05-29 WO disclosed