Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Hypoxia-inducible factor 1-alpha' and Ligand = 'BDBM50537300'   

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
Hypoxia-inducible factor 1-alpha (Homo sapiens (Human))	BDBM50537300 (CHEMBL4584063) Show SMILES CC(C)C[C@@H]1NC(=O)[C@H](CS)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)NC1=O)C(C)C |r| Show InChI InChI=1S/C38H54N6O7S/c1-21(2)16-27-34(47)41-30(18-24-10-8-7-9-11-24)36(49)44-32(23(5)6)38(51)42-29(19-25-12-14-26(45)15-13-25)35(48)43-31(20-52)37(50)40-28(17-22(3)4)33(46)39-27/h7-15,21-23,27-32,45,52H,16-20H2,1-6H3,(H,39,46)(H,40,50)(H,41,47)(H,42,51)(H,43,48)(H,44,49)/t27-,28-,29-,30-,31-,32-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	124	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Binding affinity to His-tagged HIF-1alpha (1 to 350 residues) (unknown origin) PAS B domain expressed in Escherichia coli BL21(DE3) by ITC				Bioorg Med Chem 27: 1145-1158 (2019) Article DOI: 10.1016/j.bmc.2019.01.042 BindingDB Entry DOI: 10.7270/Q2QC072Q
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