Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'High affinity nerve growth factor receptor' and Ligand = 'BDBM50224553'   

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
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM50224553 (CHEMBL5287063) Show SMILES CC(COCC(C)OCC(C)OCC(C)N(CC(O)COc1ccccc1CC=C)CC(O)COc1ccccc1CC=C)NCC(O)COc1ccccc1CC=C Show InChI InChI=1S/C48H70N2O9/c1-8-17-40-20-11-14-23-46(40)57-33-43(51)26-49-36(4)29-54-31-38(6)56-32-39(7)55-30-37(5)50(27-44(52)34-58-47-24-15-12-21-41(47)18-9-2)28-45(53)35-59-48-25-16-13-22-42(48)19-10-3/h8-16,20-25,36-39,43-45,49,51-53H,1-3,17-19,26-35H2,4-7H3	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.80	n/a	n/a	n/a	n/a	n/a	n/a
Kinki University Curated by ChEMBL					Assay Description Inhibitory activity against Dihydrofolate reductase enzyme purified from Escherichia coli				J Agric Food Chem 53: 5549-53 (2005) Article DOI: 10.1021/jf050110v
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