null

SMILES: Cc1cc2c(cc1Cc1ccc(o1)C(=O)NC[C@@H]1CC[C@H](CNC(N)=N)CC1)C(C)(C)CCC2(C)C

InChI Key: InChIKey=NNHMDUJPRLMUTO-OYRHEFFESA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50121091   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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))	BDBM50121091 (5-(3,5,5,8,8-Pentamethyl-5,6,7,8-tetrahydro-naphth...) Show SMILES Cc1cc2c(cc1Cc1ccc(o1)C(=O)NC[C@@H]1CC[C@H](CNC(N)=N)CC1)C(C)(C)CCC2(C)C |wU:20.22,17.18,(9.88,-8.62,;8.54,-7.82,;7.19,-8.59,;5.86,-7.82,;5.86,-6.28,;7.19,-5.51,;8.54,-6.28,;9.88,-5.51,;9.89,-3.97,;11.04,-2.94,;10.41,-1.55,;8.89,-1.7,;8.56,-3.2,;7.87,-.54,;6.35,-.84,;8.36,.91,;7.36,2.07,;5.84,1.77,;4.84,2.94,;3.31,2.65,;2.83,1.18,;1.31,.88,;.29,2.02,;.78,3.49,;-.25,4.64,;2.29,3.8,;3.83,.02,;5.34,.32,;4.53,-5.51,;3.2,-4.74,;5.88,-4.74,;3.2,-6.28,;3.2,-7.82,;4.53,-8.59,;5.63,-9.69,;3.04,-9.01,)| Show InChI InChI=1S/C30H44N4O2/c1-19-14-24-25(30(4,5)13-12-29(24,2)3)16-22(19)15-23-10-11-26(36-23)27(35)33-17-20-6-8-21(9-7-20)18-34-28(31)32/h10-11,14,16,20-21H,6-9,12-13,15,17-18H2,1-5H3,(H,33,35)(H4,31,32,34)/t20-,21+	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development-La Jolla/Agouron Pharmaceuticals Curated by ChEMBL					Assay Description In vitro binding affinity to human gonadotropin-releasing hormone receptor				Bioorg Med Chem Lett 12: 3467-70 (2002) BindingDB Entry DOI: 10.7270/Q20K27X7
					More data for this Ligand-Target Pair
Gonadotropin-releasing hormone receptor (Rattus norvegicus)	BDBM50121091 (5-(3,5,5,8,8-Pentamethyl-5,6,7,8-tetrahydro-naphth...) Show SMILES Cc1cc2c(cc1Cc1ccc(o1)C(=O)NC[C@@H]1CC[C@H](CNC(N)=N)CC1)C(C)(C)CCC2(C)C |wU:20.22,17.18,(9.88,-8.62,;8.54,-7.82,;7.19,-8.59,;5.86,-7.82,;5.86,-6.28,;7.19,-5.51,;8.54,-6.28,;9.88,-5.51,;9.89,-3.97,;11.04,-2.94,;10.41,-1.55,;8.89,-1.7,;8.56,-3.2,;7.87,-.54,;6.35,-.84,;8.36,.91,;7.36,2.07,;5.84,1.77,;4.84,2.94,;3.31,2.65,;2.83,1.18,;1.31,.88,;.29,2.02,;.78,3.49,;-.25,4.64,;2.29,3.8,;3.83,.02,;5.34,.32,;4.53,-5.51,;3.2,-4.74,;5.88,-4.74,;3.2,-6.28,;3.2,-7.82,;4.53,-8.59,;5.63,-9.69,;3.04,-9.01,)| Show InChI InChI=1S/C30H44N4O2/c1-19-14-24-25(30(4,5)13-12-29(24,2)3)16-22(19)15-23-10-11-26(36-23)27(35)33-17-20-6-8-21(9-7-20)18-34-28(31)32/h10-11,14,16,20-21H,6-9,12-13,15,17-18H2,1-5H3,(H,33,35)(H4,31,32,34)/t20-,21+	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	730	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development-La Jolla/Agouron Pharmaceuticals Curated by ChEMBL					Assay Description Binding affinity to rat gonadotropin-releasing hormone receptor				Bioorg Med Chem Lett 12: 3467-70 (2002) BindingDB Entry DOI: 10.7270/Q20K27X7
					More data for this Ligand-Target Pair