BDBM302899 US9598440, 37

SMILES: OC[C@H]1C[C@@H](Nc2nc(Nc3cccnc3)ncc2-c2nc3ccccc3s2)[C@H](O)[C@@H]1O

InChI Key: InChIKey=ZNYJPWJXBGPRMV-WTMJQUOKSA-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 = 302899   

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))	BDBM302899 (US9598440, 37) Show SMILES OC[C@H]1C[C@@H](Nc2nc(Nc3cccnc3)ncc2-c2nc3ccccc3s2)[C@H](O)[C@@H]1O |r| Show InChI InChI=1S/C22H22N6O3S/c29-11-12-8-16(19(31)18(12)30)26-20-14(21-27-15-5-1-2-6-17(15)32-21)10-24-22(28-20)25-13-4-3-7-23-9-13/h1-7,9-10,12,16,18-19,29-31H,8,11H2,(H2,24,25,26,28)/t12-,16-,18-,19+/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	10	n/a	n/a	n/a	n/a	n/a	n/a
MERCK SHARP & DOHME CORP. US Patent					Assay Description Procedure: A 20 μl reaction mixture contains 10 mM TriHCl, pH 7.2, 0.5 nM GST tagged IRAK4 (SignalChem), 100 nM fluorescent peptide substrate (R...				US Patent US9598440 (2017) BindingDB Entry DOI: 10.7270/Q2XG9T6V
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