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SMILES: CC(=O)N[C@H]1CCN(C1)C(=O)c1ccc(O)cc1OC[C@@H](O)CN1CCC2(Cc3cc(Cl)ccc3O2)CC1

InChI Key: InChIKey=DXKZFWGECAGFGG-GMAHTHKFSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50435675   
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 1


(Homo sapiens (Human))		BDBM50435675
PNG
(CHEMBL2391807)
Show SMILES CC(=O)N[C@H]1CCN(C1)C(=O)c1ccc(O)cc1OC[C@@H](O)CN1CCC2(Cc3cc(Cl)ccc3O2)CC1 |r|
Show InChI InChI=1S/C28H34ClN3O6/c1-18(33)30-21-6-9-32(15-21)27(36)24-4-3-22(34)13-26(24)37-17-23(35)16-31-10-7-28(8-11-31)14-19-12-20(29)2-5-25(19)38-28/h2-5,12-13,21,23,34-35H,6-11,14-17H2,1H3,(H,30,33)/t21-,23-/m0/s1
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Similars
Article
PubMed
n/an/a 89n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Antagonist activity at CCR1 in human THP1 cells assessed as inhibition of MIP-1alpha-induced chemotaxis after 2 hrs by fluorescence assay

Bioorg Med Chem Lett 23: 3500-4 (2013)


Article DOI: 10.1016/j.bmcl.2013.04.047
BindingDB Entry DOI: 10.7270/Q2FJ2J5S
More data for this
Ligand-Target Pair