BDBM50371837 CHEMBL257663

SMILES: CCc1cccc2n(CC(=O)c3ccc(Cl)cc3)c(=N)n(C)c12

InChI Key: InChIKey=CIOHYHPZIKPXGU-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50371837   

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
chemokine (C-X-C motif) receptor 3 (Homo sapiens (Human))	BDBM50371837 (CHEMBL257663) Show SMILES CCc1cccc2n(CC(=O)c3ccc(Cl)cc3)c(=N)n(C)c12 Show InChI InChI=1S/C18H18ClN3O/c1-3-12-5-4-6-15-17(12)21(2)18(20)22(15)11-16(23)13-7-9-14(19)10-8-13/h4-10,20H,3,11H2,1-2H3	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Bioresearch Center Curated by ChEMBL					Assay Description Displacement of [125]CXCL10 from human CXCR3 expressed in CHO cells				Bioorg Med Chem Lett 18: 1573-6 (2008) Article DOI: 10.1016/j.bmcl.2008.01.074 BindingDB Entry DOI: 10.7270/Q2QZ2BTF
					More data for this Ligand-Target Pair
chemokine (C-X-C motif) receptor 3 (Homo sapiens (Human))	BDBM50371837 (CHEMBL257663) Show SMILES CCc1cccc2n(CC(=O)c3ccc(Cl)cc3)c(=N)n(C)c12 Show InChI InChI=1S/C18H18ClN3O/c1-3-12-5-4-6-15-17(12)21(2)18(20)22(15)11-16(23)13-7-9-14(19)10-8-13/h4-10,20H,3,11H2,1-2H3	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Bioresearch Center Curated by ChEMBL					Assay Description Displacement of [125I]-CXCL10 from human CXCR3 expressed in CHO cell membrane				Bioorg Med Chem Lett 18: 2414-9 (2008) Article DOI: 10.1016/j.bmcl.2008.02.049 BindingDB Entry DOI: 10.7270/Q2BP03NC
					More data for this Ligand-Target Pair
chemokine (C-X-C motif) receptor 3 (Homo sapiens (Human))	BDBM50371837 (CHEMBL257663) Show SMILES CCc1cccc2n(CC(=O)c3ccc(Cl)cc3)c(=N)n(C)c12 Show InChI InChI=1S/C18H18ClN3O/c1-3-12-5-4-6-15-17(12)21(2)18(20)22(15)11-16(23)13-7-9-14(19)10-8-13/h4-10,20H,3,11H2,1-2H3	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Bioresearch Center Curated by ChEMBL					Assay Description Antagonist activity at human CXCR3 expressed in CHO cells by FLIPR-based calcium mobilization assay				Bioorg Med Chem Lett 18: 1573-6 (2008) Article DOI: 10.1016/j.bmcl.2008.01.074 BindingDB Entry DOI: 10.7270/Q2QZ2BTF
					More data for this Ligand-Target Pair