Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Motilin receptor' and Ligand = 'BDBM50599738'   

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))	BDBM50599738 (CHEMBL5192530) Show SMILES CC(C)NC(=O)Cc1cccc(O[C@H]2CC[C@@H](CC2)C(=O)N(C)c2ccc(CN3CCN[C@@H](C)C3)c(C)c2)c1 |r,wU:16.19,32.33,wD:13.12,(9.33,2.7,;8,3.47,;8,5.01,;6.67,2.7,;5.33,3.47,;5.33,5.01,;4,2.7,;2.67,3.47,;2.66,5,;1.33,5.77,;-0,5.01,;-0,3.47,;-1.34,2.7,;-1.34,1.16,;-2.67,.39,;-2.67,-1.15,;-1.34,-1.92,;-0,-1.15,;-0,.39,;-1.34,-3.46,;-0,-4.23,;-2.67,-4.23,;-2.67,-5.77,;-4,-3.46,;-4,-1.92,;-5.33,-1.15,;-6.67,-1.92,;-8,-1.15,;-8,.39,;-9.33,1.16,;-9.33,2.7,;-8,3.47,;-6.67,2.7,;-5.33,3.47,;-6.67,1.16,;-6.67,-3.47,;-8,-4.24,;-5.33,-4.23,;1.34,2.69,)| Show InChI	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.60	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1016/j.bmcl.2022.128554 BindingDB Entry DOI: 10.7270/Q2Q81J37
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