Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Gonadotropin-releasing hormone receptor' and Ligand = 'BDBM50090538'   

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
Gonadotropin-releasing hormone receptor (Rattus norvegicus)	BDBM50090538 (1-[7-Chloro-3-(3,5-dimethyl-phenyl)-2-oxo-4-(2-pip...) Show SMILES Cc1cc(C)cc(c1)-c1c(OCCC2CCCCN2)c2cc(NC(=O)NC3CC3)c(Cl)cc2[nH]c1=O Show InChI InChI=1S/C28H33ClN4O3/c1-16-11-17(2)13-18(12-16)25-26(36-10-8-19-5-3-4-9-30-19)21-14-24(33-28(35)31-20-6-7-20)22(29)15-23(21)32-27(25)34/h11-15,19-20,30H,3-10H2,1-2H3,(H,32,34)(H2,31,33,35)	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	0.800	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Compound was evaluated for its antagonism in rat primary pituitary cell assay (rLH)				Bioorg Med Chem Lett 10: 1723-7 (2000) BindingDB Entry DOI: 10.7270/Q26W99B2
					More data for this Ligand-Target Pair
Gonadotropin-releasing hormone receptor (Rattus norvegicus)	BDBM50090538 (1-[7-Chloro-3-(3,5-dimethyl-phenyl)-2-oxo-4-(2-pip...) Show SMILES Cc1cc(C)cc(c1)-c1c(OCCC2CCCCN2)c2cc(NC(=O)NC3CC3)c(Cl)cc2[nH]c1=O Show InChI InChI=1S/C28H33ClN4O3/c1-16-11-17(2)13-18(12-16)25-26(36-10-8-19-5-3-4-9-30-19)21-14-24(33-28(35)31-20-6-7-20)22(29)15-23(21)32-27(25)34/h11-15,19-20,30H,3-10H2,1-2H3,(H,32,34)(H2,31,33,35)	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	1.10	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Compound was evaluated for its inhibitory activity against rat pituitary Gonadotropin-releasing hormone receptor				Bioorg Med Chem Lett 10: 1723-7 (2000) BindingDB Entry DOI: 10.7270/Q26W99B2
					More data for this Ligand-Target Pair
Gonadotropin-releasing hormone receptor (Rattus norvegicus)	BDBM50090538 (1-[7-Chloro-3-(3,5-dimethyl-phenyl)-2-oxo-4-(2-pip...) Show SMILES Cc1cc(C)cc(c1)-c1c(OCCC2CCCCN2)c2cc(NC(=O)NC3CC3)c(Cl)cc2[nH]c1=O Show InChI InChI=1S/C28H33ClN4O3/c1-16-11-17(2)13-18(12-16)25-26(36-10-8-19-5-3-4-9-30-19)21-14-24(33-28(35)31-20-6-7-20)22(29)15-23(21)32-27(25)34/h11-15,19-20,30H,3-10H2,1-2H3,(H,32,34)(H2,31,33,35)	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	375	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Antagonist activity against Gonadotropin-releasing hormone receptor (GnRHr) in rat pituitary cells				Bioorg Med Chem Lett 10: 1723-7 (2000) BindingDB Entry DOI: 10.7270/Q26W99B2
					More data for this Ligand-Target Pair
Gonadotropin-releasing hormone receptor (Rattus norvegicus)	BDBM50090538 (1-[7-Chloro-3-(3,5-dimethyl-phenyl)-2-oxo-4-(2-pip...) Show SMILES Cc1cc(C)cc(c1)-c1c(OCCC2CCCCN2)c2cc(NC(=O)NC3CC3)c(Cl)cc2[nH]c1=O Show InChI InChI=1S/C28H33ClN4O3/c1-16-11-17(2)13-18(12-16)25-26(36-10-8-19-5-3-4-9-30-19)21-14-24(33-28(35)31-20-6-7-20)22(29)15-23(21)32-27(25)34/h11-15,19-20,30H,3-10H2,1-2H3,(H,32,34)(H2,31,33,35)	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	375	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Compound was evaluated for its antagonism in rat primary pituitary cell assay (rLH)				Bioorg Med Chem Lett 10: 1723-7 (2000) BindingDB Entry DOI: 10.7270/Q26W99B2
					More data for this Ligand-Target Pair