BDBM50162024 3-((S)-2-Cyclobutylamino-propyl)-1-(2,6-difluoro-benzyl)-5-(2-fluoro-3-methoxy-phenyl)-6-methyl-1H-pyrimidine-2,4-dione::CHEMBL179600

SMILES: COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](C)NC2CCC2)c1=O

InChI Key: InChIKey=BYDVDJCXCAYWGJ-HNNXBMFYSA-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 = 50162024   

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))	BDBM50162024 (3-((S)-2-Cyclobutylamino-propyl)-1-(2,6-difluoro-b...) Show SMILES COc1cccc(c1F)-c1c(C)n(Cc2c(F)cccc2F)c(=O)n(C[C@H](C)NC2CCC2)c1=O |wU:26.28,(2.42,6.57,;3.73,5.82,;3.73,4.28,;5.1,3.51,;5.06,1.97,;3.73,1.2,;2.42,1.98,;2.42,3.51,;1.08,4.28,;1.08,1.23,;1.08,-.33,;2.42,-1.08,;-.23,-1.08,;-.23,-2.62,;1.08,-3.39,;1.08,-4.92,;-.23,-5.69,;2.42,-5.69,;3.73,-4.92,;3.73,-3.36,;2.42,-2.61,;1.08,-1.82,;-1.58,-.33,;-2.9,-1.08,;-1.58,1.23,;-2.9,1.98,;-4.22,1.2,;-5.56,1.97,;-4.22,-.33,;-5.56,-1.12,;-5.96,-2.61,;-7.45,-2.2,;-7.05,-.71,;-.23,1.98,;-.23,3.53,)| Show InChI InChI=1S/C26H28F3N3O3/c1-15(30-17-7-4-8-17)13-32-25(33)23(18-9-5-12-22(35-3)24(18)29)16(2)31(26(32)34)14-19-20(27)10-6-11-21(19)28/h5-6,9-12,15,17,30H,4,7-8,13-14H2,1-3H3/t15-/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.60	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 for Human gonadotropin-releasing hormone receptor				J Med Chem 48: 1169-78 (2005) Article DOI: 10.1021/jm049218c BindingDB Entry DOI: 10.7270/Q2MK6CD8
					More data for this Ligand-Target Pair