BDBM50040795 CHEMBL3353193::US10023562, Example 123::US10544133, Example 123::US9657009, 123

SMILES: CC(C)Nc1cc(Nc2ncc(Cl)cc2F)ncc1C(=O)NC[C@@H](F)C(C)(C)O

InChI Key: InChIKey=JOKNBOUVTOTGOG-OAHLLOKOSA-N

Data: 4 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 4 hits for monomerid = 50040795   

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))	BDBM50040795 (CHEMBL3353193 | US10023562, Example 123 | US105441...) Show SMILES CC(C)Nc1cc(Nc2ncc(Cl)cc2F)ncc1C(=O)NC[C@@H](F)C(C)(C)O |r| Show InChI InChI=1S/C19H24ClF2N5O2/c1-10(2)26-14-6-16(27-17-13(21)5-11(20)7-24-17)23-8-12(14)18(28)25-9-15(22)19(3,4)29/h5-8,10,15,29H,9H2,1-4H3,(H,25,28)(H2,23,24,26,27)/t15-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.5	n/a	n/a	n/a	n/a	n/a	n/a
Nimbus Discovery Curated by ChEMBL					Assay Description Inhibition of IRAK4 (unknown origin) using fluoresceinated peptide and ATP after 60 mins by by Caliper assay				J Med Chem 58: 96-110 (2015) Article DOI: 10.1021/jm5016044 BindingDB Entry DOI: 10.7270/Q2P84DHS
					More data for this Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4 (Homo sapiens (Human))	BDBM50040795 (CHEMBL3353193 | US10023562, Example 123 | US105441...) Show SMILES CC(C)Nc1cc(Nc2ncc(Cl)cc2F)ncc1C(=O)NC[C@@H](F)C(C)(C)O |r| Show InChI InChI=1S/C19H24ClF2N5O2/c1-10(2)26-14-6-16(27-17-13(21)5-11(20)7-24-17)23-8-12(14)18(28)25-9-15(22)19(3,4)29/h5-8,10,15,29H,9H2,1-4H3,(H,25,28)(H2,23,24,26,27)/t15-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	3.5	n/a	n/a	n/a	n/a	n/a	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 μL prepared from 15 μL additions of enzyme and substra...				US Patent US10544133 (2020) BindingDB Entry DOI: 10.7270/Q23R0W8G
					More data for this Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4 (Homo sapiens (Human))	BDBM50040795 (CHEMBL3353193 | US10023562, Example 123 | US105441...) Show SMILES CC(C)Nc1cc(Nc2ncc(Cl)cc2F)ncc1C(=O)NC[C@@H](F)C(C)(C)O |r| Show InChI InChI=1S/C19H24ClF2N5O2/c1-10(2)26-14-6-16(27-17-13(21)5-11(20)7-24-17)23-8-12(14)18(28)25-9-15(22)19(3,4)29/h5-8,10,15,29H,9H2,1-4H3,(H,25,28)(H2,23,24,26,27)/t15-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	3.5	n/a	n/a	n/a	n/a	n/a	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 μL prepared from 15 μL additions of enzyme and substra...				US Patent US9657009 (2017) BindingDB Entry DOI: 10.7270/Q2D79DGD
					More data for this Ligand-Target Pair
Interleukin-1 receptor-associated kinase 4 (Homo sapiens (Human))	BDBM50040795 (CHEMBL3353193 | US10023562, Example 123 | US105441...) Show SMILES CC(C)Nc1cc(Nc2ncc(Cl)cc2F)ncc1C(=O)NC[C@@H](F)C(C)(C)O |r| Show InChI InChI=1S/C19H24ClF2N5O2/c1-10(2)26-14-6-16(27-17-13(21)5-11(20)7-24-17)23-8-12(14)18(28)25-9-15(22)19(3,4)29/h5-8,10,15,29H,9H2,1-4H3,(H,25,28)(H2,23,24,26,27)/t15-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	3.5	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 US10023562 (2018) BindingDB Entry DOI: 10.7270/Q2ZS2ZJR
					More data for this Ligand-Target Pair