BDBM278838 N-(3-chloro-1-methyl- 1H-pyrazol-4-yl)-2- [(1S,4S)- or (1R,4R)- 2,5-diazabicyclo[2.2.2] oct-2-yl]thieno[2,3-b] pyrazine-7- carboxamide trifluoroacetate::US10040802, Example 17

SMILES: OC(=O)C(F)(F)F.Cn1cc(NC(=O)c2csc3ncc(nc23)N2C[C@H]3CC[C@@H]2CN3)c(Cl)n1

InChI Key: InChIKey=JASRBIYGHBDNDW-DHTOPLTISA-N

Data: 1 IC50

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 = 278838   

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
Interleukin-1 receptor-associated kinase 4 (Homo sapiens (Human))	BDBM278838 (N-(3-chloro-1-methyl- 1H-pyrazol-4-yl)-2- [(1S,4S)...) Show SMILES OC(=O)C(F)(F)F.Cn1cc(NC(=O)c2csc3ncc(nc23)N2C[C@H]3CC[C@@H]2CN3)c(Cl)n1 |r| Show InChI InChI=1S/C17H18ClN7OS.C2HF3O2/c1-24-7-12(15(18)23-24)21-16(26)11-8-27-17-14(11)22-13(5-20-17)25-6-9-2-3-10(25)4-19-9;3-2(4,5)1(6)7/h5,7-10,19H,2-4,6H2,1H3,(H,21,26);(H,6,7)/t9-,10-;/m1./s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	15	n/a	n/a	n/a	n/a	7.2	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description The kinase activity of IRAK4 is determined by its ability to catalyze the phosphorylation of a fluorescent polypeptide substrate. The extent of phosp...				US Patent US10040802 (2018) BindingDB Entry DOI: 10.7270/Q298891C
					More data for this Ligand-Target Pair