Nitric Acid

Nitric Acid

SCHEMBL7007347

COC(=O)c1cc(OC)c(OCc2ccccc2)cc1[N+](=O)[O-].O=[N+]([O-])O

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
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
ALDH1A1 P00352 1/20 0.56
CTSV O60911 3/20 0.54
CTSL P07711 3/20 0.54
MAPT P10636 2/20 0.53
LMNA P02545 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.49
ABCB1 P08183 1/20 0.48
HTR1A P08908 1/20 0.48
ADRA1D P25100 1/20 0.48
ADRA1A P35348 1/20 0.48
ADRA1B P35368 1/20 0.48
KDM4E B2RXH2 1/20 0.47
HTT P42858 1/20 0.47
POLB P06746 1/20 0.47
SMPD1 P17405 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47

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
SCHEMBL2063806 0.98 MEN1 (0.57) MEN1KMT2AALDH1A1CTSVCTSL
SCHEMBL29444157 0.98 MEN1 (0.57) MEN1KMT2AALDH1A1CTSVCTSL
SCHEMBL1013111 0.98 MEN1 (0.57) MEN1KMT2AALDH1A1CTSVCTSL
SCHEMBL1783172 0.91 MEN1 (0.52) MEN1KMT2AALDH1A1CTSVCTSL
SCHEMBL2089147 0.90 MEN1 (0.54) MEN1KMT2AALDH1A1CTSVCTSL
SCHEMBL29729282 0.90 MEN1 (0.54) MEN1KMT2AALDH1A1CTSVCTSL
SCHEMBL874114 0.90 MEN1 (0.54) MEN1KMT2AALDH1A1CTSVCTSL
SCHEMBL30820477 0.90 CTSV (0.50) MEN1KMT2AALDH1A1CTSVCTSL
SCHEMBL18660057 0.90 CTSV (0.50) MEN1KMT2AALDH1A1CTSVCTSL
SCHEMBL31738326 0.88 CTSV (0.58) MEN1KMT2AALDH1A1CTSVCTSL

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
EP-1268431-A1 3-CYANOQUINOLINES,3-CYANO-1,6-NAPHTHYRIDINES, AND 3-CYANO-1,7-NAPHTHYRIDINES AS PROTEIN KINASE INHIBITORS Wyeth (US) 2003-01-02 EP disclosed
WO-2001072711-A1 3-CYANOQUINOLINES,3-CYANO-1,6-NAPHTHYRIDINES, AND 3-CYANO-1,7-NAPHTHYRIDINES AS PROTEIN KINASE INHIBITORS WYETH (US) 2001-10-04 WO disclosed