BDBM50168697 (R)-1-(2,6-difluorobenzyl)-3-(2-amino-2-phenylethyl)-5-(2-fluoro-3-methoxyphenyl)-1,3,5-triazinane-2,4,6-trione::1-((R)-2-Amino-2-phenyl-ethyl)-3-(2,6-difluoro-benzyl)-5-(2-fluoro-3-methoxy-phenyl)-[1,3,5]triazinane-2,4,6-trione::CHEMBL367388

SMILES: COc1cccc(c1F)-n1c(=O)n(C[C@H](N)c2ccccc2)c(=O)n(Cc2c(F)cccc2F)c1=O

InChI Key: InChIKey=GJNCCGNYBNRGJO-IBGZPJMESA-N

Data: 2 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 2 hits for monomerid = 50168697   

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))	BDBM50168697 ((R)-1-(2,6-difluorobenzyl)-3-(2-amino-2-phenylethy...) Show SMILES COc1cccc(c1F)-n1c(=O)n(C[C@H](N)c2ccccc2)c(=O)n(Cc2c(F)cccc2F)c1=O |r,wD:14.15,(31.35,-22.11,;30.02,-22.89,;30.02,-24.43,;31.37,-25.2,;31.37,-26.74,;30.04,-27.51,;28.71,-26.74,;28.7,-25.2,;27.36,-24.44,;27.38,-27.51,;26.05,-26.73,;26.05,-25.19,;24.72,-27.51,;23.38,-26.74,;22.05,-27.52,;22.05,-29.06,;20.72,-26.76,;20.72,-25.21,;19.38,-24.45,;18.05,-25.22,;18.06,-26.77,;19.39,-27.53,;24.72,-29.05,;23.39,-29.82,;26.06,-29.82,;26.06,-31.36,;27.4,-32.12,;28.72,-31.34,;27.38,-30.57,;30.06,-32.1,;30.07,-33.65,;28.74,-34.42,;27.4,-33.66,;26.07,-34.43,;27.38,-29.05,;28.71,-29.82,)| Show InChI InChI=1S/C25H21F3N4O4/c1-36-21-12-6-11-20(22(21)28)32-24(34)30(13-16-17(26)9-5-10-18(16)27)23(33)31(25(32)35)14-19(29)15-7-3-2-4-8-15/h2-12,19H,13-14,29H2,1H3/t19-/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	9	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
Gonadotropin releasing hormone 1 (GnRHR1) (Homo sapiens (Human))	BDBM50168697 ((R)-1-(2,6-difluorobenzyl)-3-(2-amino-2-phenylethy...) Show SMILES COc1cccc(c1F)-n1c(=O)n(C[C@H](N)c2ccccc2)c(=O)n(Cc2c(F)cccc2F)c1=O |r,wD:14.15,(31.35,-22.11,;30.02,-22.89,;30.02,-24.43,;31.37,-25.2,;31.37,-26.74,;30.04,-27.51,;28.71,-26.74,;28.7,-25.2,;27.36,-24.44,;27.38,-27.51,;26.05,-26.73,;26.05,-25.19,;24.72,-27.51,;23.38,-26.74,;22.05,-27.52,;22.05,-29.06,;20.72,-26.76,;20.72,-25.21,;19.38,-24.45,;18.05,-25.22,;18.06,-26.77,;19.39,-27.53,;24.72,-29.05,;23.39,-29.82,;26.06,-29.82,;26.06,-31.36,;27.4,-32.12,;28.72,-31.34,;27.38,-30.57,;30.06,-32.1,;30.07,-33.65,;28.74,-34.42,;27.4,-33.66,;26.07,-34.43,;27.38,-29.05,;28.71,-29.82,)| Show InChI InChI=1S/C25H21F3N4O4/c1-36-21-12-6-11-20(22(21)28)32-24(34)30(13-16-17(26)9-5-10-18(16)27)23(33)31(25(32)35)14-19(29)15-7-3-2-4-8-15/h2-12,19H,13-14,29H2,1H3/t19-/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences, Inc. Curated by ChEMBL					Assay Description In vitro ability to inhibit des-Gly[125I-Tyr, DLeu, NMeLeu,Pro-NEt]-GnRH radioligand binding to the cloned human GnRH receptor stably expressed in HE...				Bioorg Med Chem Lett 15: 3685-90 (2005) Article DOI: 10.1016/j.bmcl.2005.05.038 BindingDB Entry DOI: 10.7270/Q2DZ07TN
					More data for this Ligand-Target Pair