Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Gonadotropin-releasing hormone receptor' and Ligand = 'BDBM50104557'   

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 (Homo sapiens (Human))	BDBM50104557 (1-(8-Aza-bicyclo[3.2.1]oct-8-yl)-2-{2-(3,5-dimethy...) Show SMILES C[C@H](CNCCCCc1ccncc1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CCC2)-c1cc(C)cc(C)c1 |THB:26:28:30.31:34.35.33| Show InChI InChI=1S/C39H50N4O/c1-26-21-27(2)23-30(22-26)37-36(28(3)25-41-18-7-6-9-29-16-19-40-20-17-29)34-24-31(12-15-35(34)42-37)39(4,5)38(44)43-32-10-8-11-33(43)14-13-32/h12,15-17,19-24,28,32-33,41-42H,6-11,13-14,18,25H2,1-5H3/t28-,32?,33?/m1/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem 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 Binding inhibition towards human pituitary gonadotropin-releasing hormone receptor using [125I]-buserelin.				Bioorg Med Chem Lett 11: 2597-602 (2001) BindingDB Entry DOI: 10.7270/Q2NV9HKC
					More data for this Ligand-Target Pair
Gonadotropin-releasing hormone receptor (Homo sapiens (Human))	BDBM50104557 (1-(8-Aza-bicyclo[3.2.1]oct-8-yl)-2-{2-(3,5-dimethy...) Show SMILES C[C@H](CNCCCCc1ccncc1)c1c([nH]c2ccc(cc12)C(C)(C)C(=O)N1C2CCC1CCC2)-c1cc(C)cc(C)c1 |THB:26:28:30.31:34.35.33| Show InChI InChI=1S/C39H50N4O/c1-26-21-27(2)23-30(22-26)37-36(28(3)25-41-18-7-6-9-29-16-19-40-20-17-29)34-24-31(12-15-35(34)42-37)39(4,5)38(44)43-32-10-8-11-33(43)14-13-32/h12,15-17,19-24,28,32-33,41-42H,6-11,13-14,18,25H2,1-5H3/t28-,32?,33?/m1/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	8.80	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Binding inhibition towards human pituitary gonadotropin-releasing hormone receptor using [125I]-buserelin.				Bioorg Med Chem Lett 11: 2597-602 (2001) BindingDB Entry DOI: 10.7270/Q2NV9HKC
					More data for this Ligand-Target Pair