Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Motilin receptor' and Ligand = 'BDBM50199362'   

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
Motilin receptor (Homo sapiens (Human))	BDBM50199362 ((9R,12R,15S)-15-benzyl-9-(4-hydroxy-benzyl)-12-iso...) Show SMILES CC(C)[C@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NCCOc2ccccc2\C=C\CNC(=O)[C@H](Cc2ccccc2)NC1=O |t:28| Show InChI InChI=1S/C34H40N4O5/c1-23(2)31-34(42)37-29(22-24-9-4-3-5-10-24)32(40)36-18-8-12-26-11-6-7-13-30(26)43-20-19-35-28(33(41)38-31)21-25-14-16-27(39)17-15-25/h3-17,23,28-29,31,35,39H,18-22H2,1-2H3,(H,36,40)(H,37,42)(H,38,41)/b12-8+/t28-,29+,31-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	185	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tranzyme Pharma Inc. Curated by ChEMBL					Assay Description Displacement of [125I]motilin from human MOTR				J Med Chem 49: 7190-7 (2006) Article DOI: 10.1021/jm0606600 BindingDB Entry DOI: 10.7270/Q2251JZH
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