Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'High affinity nerve growth factor receptor' and Ligand = 'BDBM50224529'   

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))	BDBM50224529 (CHEMBL5287060) Show SMILES CC(COCC(C)N(CC(O)COc1cccc2ccccc12)CC(O)COc1cccc2ccccc12)OCC(C)OCC(C)N(CC(O)COc1cccc2ccccc12)CC(O)COc1cccc2ccccc12 Show InChI InChI=1S/C64H76N2O11/c1-45(65(33-53(67)41-74-61-29-13-21-49-17-5-9-25-57(49)61)34-54(68)42-75-62-30-14-22-50-18-6-10-26-58(50)62)37-71-39-47(3)73-40-48(4)72-38-46(2)66(35-55(69)43-76-63-31-15-23-51-19-7-11-27-59(51)63)36-56(70)44-77-64-32-16-24-52-20-8-12-28-60(52)64/h5-32,45-48,53-56,67-70H,33-44H2,1-4H3	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.10	n/a	n/a	n/a	n/a	n/a	n/a
Kinki University Curated by ChEMBL					Assay Description Vasopressin V2 receptor antagonistic activity in vivo in anesthetized rats				J Agric Food Chem 53: 5549-53 (2005) Article DOI: 10.1021/jf050110v
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