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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'C-C chemokine receptor type 2' and Ligand = 'BDBM50219904'   
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))		BDBM50219904
PNG
((S)-N-(2-(3-(3-amino-4-methylbenzylamino)-1-(tert-...)
Show SMILES Cc1ccc(CNC[C@H](NC(=O)CNC(=O)c2cccc(c2)C(F)(F)F)C(=O)NC(C)(C)C)cc1N
Show InChI InChI=1S/C25H32F3N5O3/c1-15-8-9-16(10-19(15)29)12-30-13-20(23(36)33-24(2,3)4)32-21(34)14-31-22(35)17-6-5-7-18(11-17)25(26,27)28/h5-11,20,30H,12-14,29H2,1-4H3,(H,31,35)(H,32,34)(H,33,36)/t20-/m0/s1
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PC cid
PC sid
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Similars
Article
PubMed
n/an/a 120n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Displacement of [125]MCP1 from CCR2 in human PBMCs

Bioorg Med Chem Lett 17: 5455-61 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.028
BindingDB Entry DOI: 10.7270/Q29Z94NN
More data for this
Ligand-Target Pair