BDBM50109420 CHEMBL3601241

SMILES: CC(=O)N1CC[C@@H](C1)Nc1ncc(Cl)c(NCc2cccc(NC(=O)C=C)c2)n1

InChI Key: InChIKey=JMAULYQQXNBHEK-INIZCTEOSA-N

Data: 1 IC50

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Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50109420   

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
Tyrosine-protein kinase JAK3 (Homo sapiens (Human))	BDBM50109420 (CHEMBL3601241) Show SMILES CC(=O)N1CC[C@@H](C1)Nc1ncc(Cl)c(NCc2cccc(NC(=O)C=C)c2)n1 |r| Show InChI InChI=1S/C20H23ClN6O2/c1-3-18(29)24-15-6-4-5-14(9-15)10-22-19-17(21)11-23-20(26-19)25-16-7-8-27(12-16)13(2)28/h3-6,9,11,16H,1,7-8,10,12H2,2H3,(H,24,29)(H2,22,23,25,26)/t16-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	1.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of JAK3 (unknown origin) by Z'-Lyte assay				J Med Chem 58: 6589-606 (2015) BindingDB Entry DOI: 10.7270/Q2833TSH
					More data for this Ligand-Target Pair