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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50359120   
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
C-C chemokine receptor type 2


(Homo sapiens (Human))
BDBM50359120
PNG
(CHEMBL1922796)
Show SMILES NC(=O)C(NC1CCC(CC1)c1c[nH]c2ccncc12)C1CCN(CC1)C(=O)C=Cc1cc(F)c(F)c(F)c1 |w:28.31,(52.3,5.12,;53.64,4.34,;54.97,5.11,;53.63,2.8,;52.3,2.04,;52.3,.5,;50.96,-.26,;50.95,-1.8,;52.28,-2.57,;53.62,-1.81,;53.63,-.26,;52.28,-4.11,;51.03,-5.02,;51.51,-6.49,;53.05,-6.48,;54.08,-7.62,;55.58,-7.3,;56.05,-5.83,;55.02,-4.69,;53.53,-5.02,;54.96,2.03,;54.95,.49,;56.27,-.29,;57.61,.47,;57.62,2.02,;56.29,2.8,;58.94,-.3,;58.93,-1.84,;60.28,.46,;61.61,-.32,;62.95,.44,;62.95,1.97,;64.28,2.73,;64.29,4.27,;65.62,1.96,;66.96,2.72,;65.61,.41,;66.94,-.37,;64.27,-.35,)|
Show InChI InChI=1S/C29H32F3N5O2/c30-23-13-17(14-24(31)27(23)32)1-6-26(38)37-11-8-19(9-12-37)28(29(33)39)36-20-4-2-18(3-5-20)21-16-35-25-7-10-34-15-22(21)25/h1,6-7,10,13-16,18-20,28,35-36H,2-5,8-9,11-12H2,(H2,33,39)
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 83n/an/an/an/an/an/a



Johnson& Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Antagonist activity at human CCR2


Bioorg Med Chem Lett 21: 7496-501 (2011)


Article DOI: 10.1016/j.bmcl.2011.09.113
BindingDB Entry DOI: 10.7270/Q22J6C9M
More data for this
Ligand-Target Pair