BDBM187867 US9169252, 410

SMILES: CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1Nc1cnn(c1)-c1ncccn1)-n1ncc2cc(cnc12)C#N

InChI Key: InChIKey=QZHPWIXGGWUGOP-HXUWFJFHSA-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 = 187867   

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))	BDBM187867 (US9169252, 410) Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(cc1Nc1cnn(c1)-c1ncccn1)-n1ncc2cc(cnc12)C#N |r| Show InChI InChI=1S/C25H22FN11O2/c1-25(2,39)20(26)13-32-23(38)18-12-30-21(37-22-16(10-34-37)6-15(8-27)9-31-22)7-19(18)35-17-11-33-36(14-17)24-28-4-3-5-29-24/h3-7,9-12,14,20,39H,13H2,1-2H3,(H,30,35)(H,32,38)/t20-/m1/s1	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	1.5	n/a	n/a	n/a	n/a	7.2	n/a
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well plates. The final assay volume was 30 L prepared from 15 L additions of enzyme and substrates (fluores...				US Patent US9169252 (2015) BindingDB Entry DOI: 10.7270/Q2MP5235
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