Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'C5a anaphylatoxin chemotactic receptor 1' and Ligand = 'BDBM50376834'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
C5a anaphylatoxin chemotactic receptor 1 (Homo sapiens (Human))	BDBM50376834 (CHEMBL259713) Show SMILES CCN(C1CCCc2nc(cc(OCc3ccccc3)c12)-c1c(CC)cccc1CC)c1cccc2ccccc12 |w:3.2| Show InChI InChI=1S/C38H40N2O/c1-4-28-18-12-19-29(5-2)37(28)33-25-36(41-26-27-15-8-7-9-16-27)38-32(39-33)22-14-24-35(38)40(6-3)34-23-13-20-30-17-10-11-21-31(30)34/h7-13,15-21,23,25,35H,4-6,14,22,24,26H2,1-3H3	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
Johnson& Johnson PRD Curated by ChEMBL					Assay Description Antagonist activity at human C5a receptor in U937 cells assessed as inhibition of anaphylatoxin-induced intracellular calcium mobilization				Bioorg Med Chem Lett 18: 2544-8 (2008) Article DOI: 10.1016/j.bmcl.2008.03.049 BindingDB Entry DOI: 10.7270/Q2JM2BHD
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