null

SMILES: COc1cccc(c1F)-c1c2SCC(c3ccccc3F)n2c(=O)n(C[C@H](N)c2ccccc2)c1=O

InChI Key: InChIKey=DDZZTYJJVYSXAZ-BGERDNNASA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50261244   

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))	BDBM50261244 (6-((R)-2-amino-2-phenylethyl)-8-(2-fluoro-3-methox...) Show SMILES COc1cccc(c1F)-c1c2SCC(c3ccccc3F)n2c(=O)n(C[C@H](N)c2ccccc2)c1=O |r,wD:26.29,(16.83,-7.23,;15.49,-8.01,;15.5,-9.55,;16.84,-10.32,;16.83,-11.86,;15.5,-12.63,;14.17,-11.85,;14.17,-10.32,;12.83,-9.55,;12.84,-12.62,;12.84,-14.16,;13.98,-15.19,;13.36,-16.59,;11.83,-16.43,;10.8,-17.57,;9.29,-17.25,;8.26,-18.4,;8.74,-19.86,;10.26,-20.18,;11.28,-19.03,;12.78,-19.34,;11.51,-14.93,;10.17,-14.16,;8.84,-14.92,;10.18,-12.62,;8.84,-11.85,;7.51,-12.62,;7.51,-14.16,;6.17,-11.86,;4.84,-12.63,;3.5,-11.86,;3.51,-10.31,;4.83,-9.54,;6.17,-10.31,;11.5,-11.84,;11.5,-10.3,)| Show InChI InChI=1S/C27H23F2N3O3S/c1-35-22-13-7-11-18(24(22)29)23-25(33)31(14-20(30)16-8-3-2-4-9-16)27(34)32-21(15-36-26(23)32)17-10-5-6-12-19(17)28/h2-13,20-21H,14-15,30H2,1H3/t20-,21?/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences, Inc Curated by ChEMBL					Assay Description Binding affinity at human GnRH receptor				J Med Chem 51: 3331-48 (2008) Article DOI: 10.1021/jm701249f BindingDB Entry DOI: 10.7270/Q2KD1XQ0
					More data for this Ligand-Target Pair