Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'High affinity nerve growth factor receptor' and Ligand = 'BDBM50400798'   

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))	BDBM50400798 (CHEMBL336015) Show SMILES NCCCC[C@@H]1NC(=O)c2cc(ccc2NCc2ccc(cc2NC(=O)[C@H](CO)NC1=O)C(N)=O)[N+]([O-])=O Show InChI InChI=1S/C24H29N7O7/c25-8-2-1-3-18-23(35)30-20(12-32)24(36)29-19-9-13(21(26)33)4-5-14(19)11-27-17-7-6-15(31(37)38)10-16(17)22(34)28-18/h4-7,9-10,18,20,27,32H,1-3,8,11-12,25H2,(H2,26,33)(H,28,34)(H,29,36)(H,30,35)/t18-,20-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universite£ de Sherbrooke Curated by ChEMBL					Assay Description Inhibition of TrkA assessed as inhibition of mAb5C3 binding				J Med Chem 54: 1961-2004 (2011) Article DOI: 10.1021/jm1012374 BindingDB Entry DOI: 10.7270/Q28C9XDV
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