Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Growth hormone secretagogue receptor type 1' and Ligand = 'BDBM50102239'   

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
Growth hormone secretagogue receptor type 1 (Homo sapiens (Human))	BDBM50102239 (2-[1-aminomethylcarboxamido-2-hydroxy-(1S)-ethylca...) Show SMILES CCCCCCCC(=O)OC[C@H](NC(=O)[C@H](CO)NC(=O)CN)C(=O)N1CCC2(CN(c3ccccc23)S(C)(=O)=O)CC1 Show InChI InChI=1S/C29H45N5O8S/c1-3-4-5-6-7-12-26(37)42-19-23(32-27(38)22(18-35)31-25(36)17-30)28(39)33-15-13-29(14-16-33)20-34(43(2,40)41)24-11-9-8-10-21(24)29/h8-11,22-23,35H,3-7,12-20,30H2,1-2H3,(H,31,36)(H,32,38)/t22-,23-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Functional potency measured as intracellular calcium elevation in Hek-293 cells expressing hGHSR1a				Bioorg Med Chem Lett 11: 1955-7 (2001) BindingDB Entry DOI: 10.7270/Q2DF6RR2
					More data for this Ligand-Target Pair
Growth hormone secretagogue receptor type 1 (Homo sapiens (Human))	BDBM50102239 (2-[1-aminomethylcarboxamido-2-hydroxy-(1S)-ethylca...) Show SMILES CCCCCCCC(=O)OC[C@H](NC(=O)[C@H](CO)NC(=O)CN)C(=O)N1CCC2(CN(c3ccccc23)S(C)(=O)=O)CC1 Show InChI InChI=1S/C29H45N5O8S/c1-3-4-5-6-7-12-26(37)42-19-23(32-27(38)22(18-35)31-25(36)17-30)28(39)33-15-13-29(14-16-33)20-34(43(2,40)41)24-11-9-8-10-21(24)29/h8-11,22-23,35H,3-7,12-20,30H2,1-2H3,(H,31,36)(H,32,38)/t22-,23-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	449	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Functional potency measured as intracellular calcium elevation in Hek-293 cells expressing hGHSR1a				Bioorg Med Chem Lett 11: 1955-7 (2001) BindingDB Entry DOI: 10.7270/Q2DF6RR2
					More data for this Ligand-Target Pair