Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Gonadotropin-releasing hormone receptor' and Ligand = 'BDBM50165553'   

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)	BDBM50165553 (6-(3-tert-Butyl-ureido)-2-(2-methoxy-5-nitro-benzy...) Show SMILES CCCn1c(SCc2cc(ccc2OC)[N+]([O-])=O)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCCN(C)Cc3ccccc3)c12 Show InChI InChI=1S/C35H45N7O5S/c1-7-17-41-31-28(32(43)36-16-11-18-40(5)22-24-12-9-8-10-13-24)20-26(37-33(44)39-35(2,3)4)21-29(31)38-34(41)48-23-25-19-27(42(45)46)14-15-30(25)47-6/h8-10,12-15,19-21H,7,11,16-18,22-23H2,1-6H3,(H,36,43)(H2,37,39,44)	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto 619-0216 Curated by ChEMBL					Assay Description Inhibitory concentration against rat leutinizing releasing hormone receptor				Bioorg Med Chem Lett 15: 2265-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.030 BindingDB Entry DOI: 10.7270/Q2GB23K1
					More data for this Ligand-Target Pair
Gonadotropin-releasing hormone receptor (Homo sapiens (Human))	BDBM50165553 (6-(3-tert-Butyl-ureido)-2-(2-methoxy-5-nitro-benzy...) Show SMILES CCCn1c(SCc2cc(ccc2OC)[N+]([O-])=O)nc2cc(NC(=O)NC(C)(C)C)cc(C(=O)NCCCN(C)Cc3ccccc3)c12 Show InChI InChI=1S/C35H45N7O5S/c1-7-17-41-31-28(32(43)36-16-11-18-40(5)22-24-12-9-8-10-13-24)20-26(37-33(44)39-35(2,3)4)21-29(31)38-34(41)48-23-25-19-27(42(45)46)14-15-30(25)47-6/h8-10,12-15,19-21H,7,11,16-18,22-23H2,1-6H3,(H,36,43)(H2,37,39,44)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto 619-0216 Curated by ChEMBL					Assay Description Inhibitory concentration against human leutinizing releasing hormone receptor				Bioorg Med Chem Lett 15: 2265-9 (2005) Article DOI: 10.1016/j.bmcl.2005.03.030 BindingDB Entry DOI: 10.7270/Q2GB23K1
					More data for this Ligand-Target Pair