Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Growth hormone secretagogue receptor type 1' and Ligand = 'BDBM50544348'   

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))	BDBM50544348 (CHEMBL4637284) Show SMILES CN(C)CCNC(=O)[C@H]1CN(C[C@@H]1NC(=O)c1cc2cc(C)ccc2[nH]1)S(=O)(=O)c1cnccn1 |r| Show InChI InChI=1S/C23H29N7O4S/c1-15-4-5-18-16(10-15)11-19(27-18)23(32)28-20-14-30(35(33,34)21-12-24-6-7-25-21)13-17(20)22(31)26-8-9-29(2)3/h4-7,10-12,17,20,27H,8-9,13-14H2,1-3H3,(H,26,31)(H,28,32)/t17-,20-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	29	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Displacement of [His[125I]]-ghrelin from GHS-R1a (unknown origin) expressed in HEK293 cell membranes measured after 1 hr by microbeta counting method				J Med Chem 63: 9705-9730 (2020) Article DOI: 10.1021/acs.jmedchem.0c00828 BindingDB Entry DOI: 10.7270/Q2445R3K
					More data for this Ligand-Target Pair
Growth hormone secretagogue receptor type 1 (Homo sapiens (Human))	BDBM50544348 (CHEMBL4637284) Show SMILES CN(C)CCNC(=O)[C@H]1CN(C[C@@H]1NC(=O)c1cc2cc(C)ccc2[nH]1)S(=O)(=O)c1cnccn1 |r| Show InChI InChI=1S/C23H29N7O4S/c1-15-4-5-18-16(10-15)11-19(27-18)23(32)28-20-14-30(35(33,34)21-12-24-6-7-25-21)13-17(20)22(31)26-8-9-29(2)3/h4-7,10-12,17,20,27H,8-9,13-14H2,1-3H3,(H,26,31)(H,28,32)/t17-,20-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Displacement of [His[125I]]-ghrelin from GHS-R1a (unknown origin) expressed in HEK293 cell membranes measured after 1 hr by microbeta counting method				J Med Chem 63: 9705-9730 (2020) Article DOI: 10.1021/acs.jmedchem.0c00828 BindingDB Entry DOI: 10.7270/Q2445R3K
					More data for this Ligand-Target Pair
Growth hormone secretagogue receptor type 1 (Homo sapiens (Human))	BDBM50544348 (CHEMBL4637284) Show SMILES CN(C)CCNC(=O)[C@H]1CN(C[C@@H]1NC(=O)c1cc2cc(C)ccc2[nH]1)S(=O)(=O)c1cnccn1 |r| Show InChI InChI=1S/C23H29N7O4S/c1-15-4-5-18-16(10-15)11-19(27-18)23(32)28-20-14-30(35(33,34)21-12-24-6-7-25-21)13-17(20)22(31)26-8-9-29(2)3/h4-7,10-12,17,20,27H,8-9,13-14H2,1-3H3,(H,26,31)(H,28,32)/t17-,20-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Agonist activity at human GHSR expressed in HEK293 cells assessed as increase in IP1 accumulation measured after 90 mins in presence of LiCl by HTRF ...				J Med Chem 63: 9705-9730 (2020) Article DOI: 10.1021/acs.jmedchem.0c00828 BindingDB Entry DOI: 10.7270/Q2445R3K
					More data for this Ligand-Target Pair
Growth hormone secretagogue receptor type 1 (Homo sapiens (Human))	BDBM50544348 (CHEMBL4637284) Show SMILES CN(C)CCNC(=O)[C@H]1CN(C[C@@H]1NC(=O)c1cc2cc(C)ccc2[nH]1)S(=O)(=O)c1cnccn1 |r| Show InChI InChI=1S/C23H29N7O4S/c1-15-4-5-18-16(10-15)11-19(27-18)23(32)28-20-14-30(35(33,34)21-12-24-6-7-25-21)13-17(20)22(31)26-8-9-29(2)3/h4-7,10-12,17,20,27H,8-9,13-14H2,1-3H3,(H,26,31)(H,28,32)/t17-,20-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Agonist activity at human GHSR expressed in HEK293 cells assessed as increase in IP1 accumulation measured after 90 mins in presence of LiCl by HTRF ...				J Med Chem 63: 9705-9730 (2020) Article DOI: 10.1021/acs.jmedchem.0c00828 BindingDB Entry DOI: 10.7270/Q2445R3K
					More data for this Ligand-Target Pair