BDBM50375880 CHEMBL405449

SMILES: CCOC(=O)c1cn(Cc2c(F)cccc2F)c2cc(c(CN(C)Cc3ccccc3)cc2c1=O)-c1ccc(NC(=O)CC)cc1

InChI Key: InChIKey=JBODSIHHJZNESW-UHFFFAOYSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50375880   

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 1 (GnRHR1) (Homo sapiens (Human))	BDBM50375880 (CHEMBL405449) Show SMILES CCOC(=O)c1cn(Cc2c(F)cccc2F)c2cc(c(CN(C)Cc3ccccc3)cc2c1=O)-c1ccc(NC(=O)CC)cc1 Show InChI InChI=1S/C37H35F2N3O4/c1-4-35(43)40-27-16-14-25(15-17-27)28-19-34-29(18-26(28)21-41(3)20-24-10-7-6-8-11-24)36(44)31(37(45)46-5-2)23-42(34)22-30-32(38)12-9-13-33(30)39/h6-19,23H,4-5,20-22H2,1-3H3,(H,40,43)	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	50	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences Curated by ChEMBL					Assay Description Inhibition of GnRH receptor				Bioorg Med Chem 16: 422-7 (2008) Article DOI: 10.1016/j.bmc.2007.09.026 BindingDB Entry DOI: 10.7270/Q2Z60PXR
					More data for this Ligand-Target Pair