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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Monocarboxylate Transporter 1' and Ligand = 'BDBM21990'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Monocarboxylate Transporter 1


(Homo sapiens (Human))
BDBM21990
PNG
(5-(azetidin-1-ylcarbonyl)-3-methyl-6-{[2-(methylam...)
Show SMILES CNc1nc2ccccc2n1Cc1sc2n(CC(C)C)c(=O)n(C)c(=O)c2c1C(=O)N1CCC1
Show InChI InChI=1S/C24H28N6O3S/c1-14(2)12-30-22-19(20(31)27(4)24(30)33)18(21(32)28-10-7-11-28)17(34-22)13-29-16-9-6-5-8-15(16)26-23(29)25-3/h5-6,8-9,14H,7,10-13H2,1-4H3,(H,25,26)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
59 -40.8n/an/an/an/an/a7.822



AstraZeneca



Assay Description
Jurkat cell membranes were incubated with [3H]-labeled ligand in the absence or presence of increasing concentrations of test compound. The reagents ...


J Med Chem 50: 254-63 (2007)


Article DOI: 10.1021/jm060995h
BindingDB Entry DOI: 10.7270/Q2GT5KGF
More data for this
Ligand-Target Pair