BDBM50434054 CHEMBL2381216

SMILES: CN(C)c1ccc(\C=C2/SC(=NC2=O)N2CCN(CCO)CC2)cc1

InChI Key: InChIKey=NHVKSDMVCUUQNU-SSZFMOIBSA-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 = 50434054   

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-X-C chemokine receptor type 7 (CXCR7) (Homo sapiens (Human))	BDBM50434054 (CHEMBL2381216) Show SMILES CN(C)c1ccc(\C=C2/SC(=NC2=O)N2CCN(CCO)CC2)cc1 |c:10| Show InChI InChI=1S/C18H24N4O2S/c1-20(2)15-5-3-14(4-6-15)13-16-17(24)19-18(25-16)22-9-7-21(8-10-22)11-12-23/h3-6,13,23H,7-12H2,1-2H3/b16-13-	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.36E+3	n/a	n/a	n/a	n/a	n/a	n/a
PharmaDesign Inc. Curated by ChEMBL					Assay Description Displacement of [125I]SDF-1alpha from CXCR7 (unknown origin) expressed in CHO cells after 1 hr by TopCount scintillation counting analysis				J Med Chem 56: 4236-51 (2013) Article DOI: 10.1021/jm400307y BindingDB Entry DOI: 10.7270/Q2W66N54
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