Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Gonadotropin-releasing hormone receptor' and Ligand = 'BDBM50224091'   

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))	BDBM50224091 (CHEMBL442482) Show SMILES [H][C@@]12[C@@H](C)C(=O)[C@H](C)C[C@](C)(OC)[C@H](OC3O[C@H](C)C[C@@H]([C@H]3O)N(C)C3CCCC3)[C@@H](C)[C@H](OC3C[C@@](C)(OC)[C@@H](O)[C@H](C)O3)[C@@H](C)C(=O)O[C@H](CC)[C@@]1(C)OC(=O)N2CCc1ccc(Cl)cc1 Show InChI InChI=1S/C51H81ClN2O13/c1-14-38-51(10)43(54(48(59)67-51)24-23-34-19-21-35(52)22-20-34)30(4)40(55)28(2)26-50(9,61-13)45(66-47-41(56)37(25-29(3)62-47)53(11)36-17-15-16-18-36)31(5)42(32(6)46(58)64-38)65-39-27-49(8,60-12)44(57)33(7)63-39/h19-22,28-33,36-39,41-45,47,56-57H,14-18,23-27H2,1-13H3/t28-,29-,30+,31+,32-,33+,37+,38-,39?,41-,42+,43-,44+,45-,47?,49-,50+,51-/m1/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	7.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Binding affinity against human luteinizing releasing hormone receptor cloned in CHO cells				Bioorg Med Chem Lett 14: 1599-602 (2004) BindingDB Entry DOI: 10.7270/Q27083NK
					More data for this Ligand-Target Pair