BDBM50434060 CHEMBL1430708

SMILES: CCC(C(=O)NCCCN(CC)Cc1ccccc1)n1nc(C)c2sc3ccccc3c2c1=O

InChI Key: InChIKey=RLDIEDXPMOXHJI-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 = 50434060   

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))	BDBM50434060 (CHEMBL1430708) Show SMILES CCC(C(=O)NCCCN(CC)Cc1ccccc1)n1nc(C)c2sc3ccccc3c2c1=O Show InChI InChI=1S/C27H32N4O2S/c1-4-22(26(32)28-16-11-17-30(5-2)18-20-12-7-6-8-13-20)31-27(33)24-21-14-9-10-15-23(21)34-25(24)19(3)29-31/h6-10,12-15,22H,4-5,11,16-18H2,1-3H3,(H,28,32)	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.78E+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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