Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Baculoviral IAP repeat-containing protein 3' and Ligand = 'BDBM50078367'   

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
Baculoviral IAP repeat-containing protein 3 (Homo sapiens (Human))	BDBM50078367 (CHEMBL3414712) Show SMILES [H][C@@]12CCCN1C(=O)[C@H](Cc1cn(CCOc3ccc(C[C@H](NC(=O)[C@H](Cc4ccccc4)NC2=O)C(O)=O)cc3)nn1)NC(=O)[C@H](C)NC |r| Show InChI InChI=1S/C34H42N8O7/c1-21(35-2)30(43)37-27-19-24-20-41(40-39-24)15-16-49-25-12-10-23(11-13-25)18-28(34(47)48)38-31(44)26(17-22-7-4-3-5-8-22)36-32(45)29-9-6-14-42(29)33(27)46/h3-5,7-8,10-13,20-21,26-29,35H,6,9,14-19H2,1-2H3,(H,36,45)(H,37,43)(H,38,44)(H,47,48)/t21-,26-,27-,28-,29-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.32E+3	n/a	n/a	n/a	n/a	n/a	n/a
Ensemble Therapeutics Corp Curated by ChEMBL					Assay Description Inhibition of XIAP BIR3 (241 to 356 residues) (unknown origin) incubated for 60 mins by fluoresceinated modified SMAC peptide based fluorescence pola...				J Med Chem 58: 2855-61 (2015) Article DOI: 10.1021/jm501892g BindingDB Entry DOI: 10.7270/Q2RF5WQ0
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