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BDBM374626 1-(1-(2,4-Dichlorophenyl)ethyl)-6-(3′-ethyl-[1,4′-bipiperidin]-1′-yl)-1H-pyrazolo[3,4-b]pyrazine-3-carbonitrile 2,2,2-trifluoroacetate::US10246462, Example 7

SMILES: CCC1CN(CCC1N1CCCCC1)c1cnc2c(nn(C(C)c3ccc(Cl)cc3Cl)c2n1)C#N

InChI Key: InChIKey=ZAHCYMHFSRMAIT-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 374626   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
C-C chemokine receptor type 4


(Homo sapiens (Human))
BDBM374626
PNG
(1-(1-(2,4-Dichlorophenyl)ethyl)-6-(3′-ethyl-...)
Show SMILES CCC1CN(CCC1N1CCCCC1)c1cnc2c(nn(C(C)c3ccc(Cl)cc3Cl)c2n1)C#N
Show InChI InChI=1S/C26H31Cl2N7/c1-3-18-16-34(12-9-23(18)33-10-5-4-6-11-33)24-15-30-25-22(14-29)32-35(26(25)31-24)17(2)20-8-7-19(27)13-21(20)28/h7-8,13,15,17-18,23H,3-6,9-12,16H2,1-2H3
UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 300n/an/an/an/an/an/a



St. Jude Research Hospital



Assay Description
To measure binding of 125I-TARC or 125I-MDC to cells expressing CCR4 (e.g., CEM cells (e.g., ATCC HB-12624)), the 125I-TARC or 125I-MDC is diluted to...


J Med Chem 50: 1876-85 (2007)


BindingDB Entry DOI: 10.7270/Q24F1T13
More data for this
Ligand-Target Pair