BDBM188989 US9169260, 255

SMILES: Cc1ccc(cc1)-n1nc(cc1NC(=O)c1cnn2cccnc12)C1CCN(CC1)C1CCC2(CCC(=O)N2)CC1

InChI Key: InChIKey=AIAKSDKMERCMCG-UHFFFAOYSA-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 = 188989   

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))	BDBM188989 (US9169260, 255) Show SMILES Cc1ccc(cc1)-n1nc(cc1NC(=O)c1cnn2cccnc12)C1CCN(CC1)C1CCC2(CCC(=O)N2)CC1 |(9.2,2.47,;7.72,2.07,;7.32,.58,;5.83,.18,;4.74,1.27,;5.14,2.76,;6.63,3.16,;3.25,.87,;2.78,-.59,;1.24,-.59,;.76,.87,;2.01,1.78,;2.01,3.32,;.67,4.09,;-.66,3.32,;.67,5.63,;1.92,6.53,;1.44,8,;-.1,8,;-1.13,9.14,;-2.63,8.82,;-3.11,7.36,;-2.08,6.21,;-.57,6.53,;.15,-1.68,;-1.34,-1.28,;-2.43,-2.37,;-2.03,-3.86,;-.54,-4.26,;.55,-3.17,;-3.12,-4.95,;-4.6,-4.55,;-5.69,-5.64,;-5.29,-7.13,;-5.29,-8.67,;-6.76,-9.14,;-7.66,-7.9,;-9.2,-7.9,;-6.76,-6.65,;-3.81,-7.52,;-2.72,-6.44,)| Show InChI InChI=1S/C31H36N8O2/c1-21-3-5-24(6-4-21)39-27(34-30(41)25-20-33-38-16-2-15-32-29(25)38)19-26(36-39)22-10-17-37(18-11-22)23-7-12-31(13-8-23)14-9-28(40)35-31/h2-6,15-16,19-20,22-23H,7-14,17-18H2,1H3,(H,34,41)(H,35,40)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	<100	n/a	n/a	n/a	n/a	7.2	n/a
MERCK SHARP & DOHME CORP. US Patent					Assay Description The kinase activity of IRAK-4 is determined by its ability to catalyze the phosphorylation of a fluorescent polypeptide substrate. The extent of phos...				US Patent US9169260 (2015) BindingDB Entry DOI: 10.7270/Q26H4G6N
					More data for this Ligand-Target Pair