BDBM210162 US9546153, ex. 293::US9546153, ex. 299

SMILES: CC(C)(O)[C@H](F)CNC(=O)c1cnc(Nc2ccn3nccc3c2)cc1NC1CCC(F)(F)C1

InChI Key: InChIKey=KQJAMODYXRMAIQ-XCWJXAQQSA-N

Data: 2 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 2 hits for monomerid = 210162   

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))	BDBM210162 (US9546153, ex. 293 | US9546153, ex. 299) Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(Nc2ccn3nccc3c2)cc1NC1CCC(F)(F)C1 |r| Show InChI InChI=1S/C23H27F3N6O2/c1-22(2,34)19(24)13-28-21(33)17-12-27-20(10-18(17)30-15-3-6-23(25,26)11-15)31-14-5-8-32-16(9-14)4-7-29-32/h4-5,7-10,12,15,19,34H,3,6,11,13H2,1-2H3,(H,28,33)(H2,27,30,31)/t15?,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	1.70	n/a	n/a	n/a	n/a	7.2	25
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μL prepared from 15 μL additions of enzyme and substra...				US Patent US9546153 (2017) BindingDB Entry DOI: 10.7270/Q28C9Z71
					More data for this Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4 (Homo sapiens (Human))	BDBM210162 (US9546153, ex. 293 | US9546153, ex. 299) Show SMILES CC(C)(O)[C@H](F)CNC(=O)c1cnc(Nc2ccn3nccc3c2)cc1NC1CCC(F)(F)C1 |r| Show InChI InChI=1S/C23H27F3N6O2/c1-22(2,34)19(24)13-28-21(33)17-12-27-20(10-18(17)30-15-3-6-23(25,26)11-15)31-14-5-8-32-16(9-14)4-7-29-32/h4-5,7-10,12,15,19,34H,3,6,11,13H2,1-2H3,(H,28,33)(H2,27,30,31)/t15?,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	1.80	n/a	n/a	n/a	n/a	7.2	25
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μL prepared from 15 μL additions of enzyme and substra...				US Patent US9546153 (2017) BindingDB Entry DOI: 10.7270/Q28C9Z71
					More data for this Ligand-Target Pair