Nitric Acid

Nitric Acid

SCHEMBL1591

NC(N)=Nc1cccc(OC(F)(F)F)c1.O=[N+]([O-])O

nearest known ligand 0.51

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
HTR3E A5X5Y0 5/20 0.51
HTR3B O95264 5/20 0.51
HTR3A P46098 5/20 0.51
HTR3D Q70Z44 5/20 0.51
HTR3C Q8WXA8 5/20 0.51
TAAR1 Q96RJ0 1/20 0.50
HGFAC Q04756 2/20 0.46
PRSS1 P07477 2/20 0.44
ACR P10323 2/20 0.44
ITGB3 P05106 1/20 0.41
ITGAV P06756 1/20 0.41
FURIN P09958 2/20 0.41
PLAU P00749 2/20 0.41
SLC22A2 O15244 1/20 0.41
SLC22A1 O15245 1/20 0.41
SLC22A3 O75751 1/20 0.41
MPI P34949 1/20 0.40
MEN1 O00255 1/20 0.38
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38

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 SCHEMBL1412 0.88 HTR3E (0.48) HTR3EHTR3BHTR3AHTR3DHTR3C
Nitric Acid SCHEMBL2913167 0.81 HTR3E (0.79) HTR3EHTR3BHTR3AHTR3DHTR3C
Nitric Acid SCHEMBL5733225 0.78 HTR3E (0.79) HTR3EHTR3BHTR3AHTR3DHTR3C
Nitric Acid SCHEMBL1363670 0.76 HTR3E (0.48) HTR3EHTR3BHTR3AHTR3DHTR3C
Nitric Acid SCHEMBL1590 0.76 MAPT (0.50) MEN1TP53MAPTCASP3HTT
Nitric Acid SCHEMBL7234964 0.75 MAOB (0.50) HTR3EHTR3BHTR3AHTR3DHTR3C
Nitric Acid SCHEMBL5471239 0.74 HTR3E (0.49) HTR3EHTR3BHTR3AHTR3DHTR3C
Nitric Acid SCHEMBL1368 0.73 HTR3E (0.72) HTR3EHTR3BHTR3AHTR3DHTR3C
Nitric Acid SCHEMBL3250038 0.73 HTR3E (0.48) HTR3EHTR3BHTR3AHTR3DHTR3C
Nitric Acid SCHEMBL2862598 0.73 HTR3E (0.77) HTR3EHTR3BHTR3AHTR3DHTR3C

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-5521184-A ANTITUMOR AGENTS; imatinib mesylate CIBA-GEIGY CORPORATION (US) 1996-05-28 US disclosed