Showing entry for Atrazine


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0031040
Compound NameAtrazine
Structure
FormulaC8H14ClN5
InchiKeyMXWJVTOOROXGIU-UHFFFAOYSA-N
SMILESCCN=c1nc(Cl)[nH]c(=NC(C)C)[nH]1
InchiInChI=1S/C8H14ClN5/c1-4-10-7-12-6(9)13-8(14-7)11-5(2)3/h5H,4H2,1-3H3,(H2,10,11,12,13,14)
IUPAC6-chloro-4-N-ethyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine
Molecular Weight215.09
Pubchem Id2256
Chembl IdCHEMBL15063
Targets of Information Source
DrugBank DB07392
Uniport Id BXGT Id Protein Name Status Protein Class Gene Groups Target Type
Uniport Id BXGT Id Protein Name Status Protein Class Gene Groups Target Type
P07173 BXGT006562 Photosynthetic reaction center cytochrome c subunit reviewed - pufC experimental -
P06008 BXGT006405 Reaction center protein H chain reviewed - puhA experimental -
P06009 BXGT006406 Reaction center protein L chain reviewed - pufL experimental -
P06010 BXGT006407 Reaction center protein M chain reviewed - pufM experimental -
PDB ATZ
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM Ka M-1
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM Ka M-1
P06009 BXGT006406 Reaction center protein L chain reviewed pufL - - - - -
Binding DB n.a
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM EC50 nM
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM EC50 nM
CHEMBL CHEMBL15063
Uniport Id BXGT Id Protein Name Status Protein Class Gene width="10%">Type Relation value Units
Uniport Id BXGT Id Protein Name Status Protein Class Gene Type Relation value Units
Q9R1A7 BXGT021413 Nuclear receptor subfamily 1 group I member 2 reviewed - Nr1i2 Potency - 89125 nM
P46225 BXGT010512 Triosephosphate isomerase, chloroplastic reviewed - Activity '=' 7 nmol/sec
Q03181 BXGT012701 Peroxisome proliferator-activated receptor delta reviewed Nuclear receptor PPARD Potency - 177 nM
Q9NPD5 BXGT021151 Solute carrier organic anion transporter family member 1B3 reviewed Transporter SLCO1B3 Inhibition '=' 96 %
Q9XQA6 BXGT022185 Photosystem II protein D1 unreviewed - psbA Ratio '>' 625 -
Q9Y6L6 BXGT022334 Solute carrier organic anion transporter family member 1B1 reviewed Transporter SLCO1B1 Inhibition '=' 133 %
P08659 BXGT006805 Luciferin 4-monooxygenase reviewed - EC50 '>' 112219 nM
P00166 BXGT005472 Cytochrome b6-f complex subunit 4 reviewed - petD IC50 '=' 281 nM
P51450 BXGT010847 Nuclear receptor ROR-gamma reviewed - Rorc Potency '=' 15848 nM
Q31945 BXGT014314 Chloroplast thylakoid membrane protein (psbA) unreviewed - IC50 '=' 61659 nM
P00166 BXGT005472 Cytochrome b6-f complex subunit 4 reviewed - petD IC50 '=' 186 nM
P43220 BXGT010367 Glucagon-like peptide 1 receptor reviewed G-protein coupled receptor GLP1R Potency - 11220 nM
Q9UNA4 BXGT021785 DNA polymerase iota reviewed - POLI Potency - 89125 nM
Q31945 BXGT014314 Chloroplast thylakoid membrane protein (psbA) unreviewed - Selectivity ratio '=' 324 -
Q9XQA6 BXGT022185 Photosystem II protein D1 unreviewed - psbA IC50 '=' 160 nM
P51449 BXGT010846 Nuclear receptor ROR-gamma reviewed Nuclear receptor RORC Potency - 2660 nM
O94925 BXGT005342 Glutaminase kidney isoform, mitochondrial reviewed Enzyme GLS Potency - 4466 nM
Q31945 BXGT014314 Chloroplast thylakoid membrane protein (psbA) unreviewed - IC50 '=' 190 nM
P46225 BXGT010512 Triosephosphate isomerase, chloroplastic reviewed - Inhibition '=' 26 %
Q9XQA6 BXGT022185 Photosystem II protein D1 unreviewed - psbA IC50 '>' 100000 nM
Q13148 BXGT013318 TAR DNA-binding protein 43 reviewed - TARDBP Potency - 22387 nM
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF00125 Rice Oryza sativa Cereals and cereal products
The  compound-realted  diseases
Diseases
BXGD Id Disease Name CUI Disease Id Disease Class Name Number of targets?Number of targets related to compound connecting disease, higher numbers indicate the compound is more associated with the disease