BDBM278855 2-[(3S)- or (3R)- azepan-3-ylamino]-N- [3-(difluoromethyl)-1- methyl-1H-pyrazol-4- yl]thieno[2,3-b] pyrazine-7- carboxamide trifluoroacetate::US10040802, Example 34

SMILES: OC(=O)C(F)(F)F.Cn1cc(NC(=O)c2csc3ncc(N[C@H]4CCCCNC4)nc23)c(n1)C(F)F

InChI Key: InChIKey=RCFSZQZPPRBCJO-PPHPATTJSA-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 = 278855   

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))	BDBM278855 (2-[(3S)- or (3R)- azepan-3-ylamino]-N- [3-(difluor...) Show SMILES OC(=O)C(F)(F)F.Cn1cc(NC(=O)c2csc3ncc(N[C@H]4CCCCNC4)nc23)c(n1)C(F)F |r| Show InChI InChI=1S/C18H21F2N7OS.C2HF3O2/c1-27-8-12(15(26-27)16(19)20)24-17(28)11-9-29-18-14(11)25-13(7-22-18)23-10-4-2-3-5-21-6-10;3-2(4,5)1(6)7/h7-10,16,21H,2-6H2,1H3,(H,23,25)(H,24,28);(H,6,7)/t10-;/m0./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	2	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