Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'C5a anaphylatoxin chemotactic receptor 1' and Ligand = 'BDBM50066478'   

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))	BDBM50066478 ((S)-1-[(S)-6-Amino-2-((S)-2-methylamino-3-phenyl-p...) Show SMILES CN[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@H](CC1CCCCC1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CCCNC(N)=N)C(N)=O Show InChI InChI=1S/C47H70N12O6/c1-52-37(26-30-14-4-2-5-15-30)42(61)56-36(20-10-11-23-48)46(65)59-25-13-22-40(59)45(64)58-38(27-31-16-6-3-7-17-31)43(62)57-39(28-32-29-54-34-19-9-8-18-33(32)34)44(63)55-35(41(49)60)21-12-24-53-47(50)51/h2,4-5,8-9,14-15,18-19,29,31,35-40,52,54H,3,6-7,10-13,16-17,20-28,48H2,1H3,(H2,49,60)(H,55,63)(H,56,61)(H,57,62)(H,58,64)(H4,50,51,53)/t35-,36+,37+,38-,39+,40+/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
University of Queensland Curated by ChEMBL					Assay Description 50% reduction in myeloperoxidase secretion from human PMNs mediated by 100 nM C5a				J Med Chem 41: 3417-25 (1998) Article DOI: 10.1021/jm9800651 BindingDB Entry DOI: 10.7270/Q2C828FP
					More data for this Ligand-Target Pair
C5a anaphylatoxin chemotactic receptor 1 (Homo sapiens (Human))	BDBM50066478 ((S)-1-[(S)-6-Amino-2-((S)-2-methylamino-3-phenyl-p...) Show SMILES CN[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@H](CC1CCCCC1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](CCCNC(N)=N)C(N)=O Show InChI InChI=1S/C47H70N12O6/c1-52-37(26-30-14-4-2-5-15-30)42(61)56-36(20-10-11-23-48)46(65)59-25-13-22-40(59)45(64)58-38(27-31-16-6-3-7-17-31)43(62)57-39(28-32-29-54-34-19-9-8-18-33(32)34)44(63)55-35(41(49)60)21-12-24-53-47(50)51/h2,4-5,8-9,14-15,18-19,29,31,35-40,52,54H,3,6-7,10-13,16-17,20-28,48H2,1H3,(H2,49,60)(H,55,63)(H,56,61)(H,57,62)(H,58,64)(H4,50,51,53)/t35-,36+,37+,38-,39+,40+/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Queensland Curated by ChEMBL					Assay Description 50% reduction in binding of [125I]-C5a to human polymorphonuclear cells (PMNs)				J Med Chem 41: 3417-25 (1998) Article DOI: 10.1021/jm9800651 BindingDB Entry DOI: 10.7270/Q2C828FP
					More data for this Ligand-Target Pair