BDBM50274477 CHEMBL4128514

SMILES: CN(C1CCN(CCCN2CCCc3c(Nc4ccccn4)nccc3C2=O)CC1)S(C)(=O)=O

InChI Key: InChIKey=PHGBLXKKBSMWFT-UHFFFAOYSA-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 = 50274477   

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 2 (Homo sapiens (Human))	BDBM50274477 (CHEMBL4128514) Show SMILES CN(C1CCN(CCCN2CCCc3c(Nc4ccccn4)nccc3C2=O)CC1)S(C)(=O)=O Show InChI InChI=1S/C24H34N6O3S/c1-28(34(2,32)33)19-10-17-29(18-11-19)14-6-16-30-15-5-7-20-21(24(30)31)9-13-26-23(20)27-22-8-3-4-12-25-22/h3-4,8-9,12-13,19H,5-7,10-11,14-18H2,1-2H3,(H,25,26,27)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	550	n/a	n/a	n/a	n/a	n/a	n/a
Shanghai Institute of Materia Medica Curated by ChEMBL					Assay Description Antagonist activity at CCR2 (unknown origin) expressed in CHOK1 cells co-expressing Ga16 assessed as inhibition of CCL2 induced intracellular Ca2+ mo...				Bioorg Med Chem 26: 3559-3572 (2018) Article DOI: 10.1016/j.bmc.2018.05.027 BindingDB Entry DOI: 10.7270/Q2H41TZH
					More data for this Ligand-Target Pair