BDBM50445009 CHEMBL3099940

SMILES: O[C@H](COc1ccccc1NC(=O)N1CCCC1)CN1CCC2(Cc3cc(Cl)ccc3O2)CC1

InChI Key: InChIKey=DUKMTYTZDQEOLB-NRFANRHFSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50445009   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
C-C chemokine receptor type 1 (Homo sapiens (Human))	BDBM50445009 (CHEMBL3099940) Show SMILES O[C@H](COc1ccccc1NC(=O)N1CCCC1)CN1CCC2(Cc3cc(Cl)ccc3O2)CC1 |r| Show InChI InChI=1S/C26H32ClN3O4/c27-20-7-8-23-19(15-20)16-26(34-23)9-13-29(14-10-26)17-21(31)18-33-24-6-2-1-5-22(24)28-25(32)30-11-3-4-12-30/h1-2,5-8,15,21,31H,3-4,9-14,16-18H2,(H,28,32)/t21-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.40	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Displacement of [125I]MIP-1alpha from human recombinant CCR1 expressed in HEK293 cell membranes after 1.5 hrs by microbeta counting analysis				Bioorg Med Chem Lett 24: 108-12 (2013) Article DOI: 10.1016/j.bmcl.2013.11.062 BindingDB Entry DOI: 10.7270/Q28K7BJX
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