BDBM26387 Aminopyrimidine amide, 33::N-{4-ethyl-3-[(2-{[4-(4-methylpiperazin-1-yl)phenyl]amino}pyrimidin-5-yl)carbamoyl]phenyl}-2,2-difluoro-2H-1,3-benzodioxole-5-carboxamide

SMILES: CCc1ccc(NC(=O)c2ccc3OC(F)(F)Oc3c2)cc1C(=O)Nc1cnc(Nc2ccc(cc2)N2CCN(C)CC2)nc1

InChI Key: InChIKey=ORWVKNRINMANEF-UHFFFAOYSA-N

Data: 5 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 5 hits for monomerid = 26387   

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 Lck (Homo sapiens (Human))	BDBM26387 (Aminopyrimidine amide, 33 | N-{4-ethyl-3-[(2-{[4-(...) Show SMILES CCc1ccc(NC(=O)c2ccc3OC(F)(F)Oc3c2)cc1C(=O)Nc1cnc(Nc2ccc(cc2)N2CCN(C)CC2)nc1 Show InChI InChI=1S/C32H31F2N7O4/c1-3-20-4-6-23(37-29(42)21-5-11-27-28(16-21)45-32(33,34)44-27)17-26(20)30(43)38-24-18-35-31(36-19-24)39-22-7-9-25(10-8-22)41-14-12-40(2)13-15-41/h4-11,16-19H,3,12-15H2,1-2H3,(H,37,42)(H,38,43)(H,35,36,39)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6	n/a	n/a	n/a	n/a	7.5	22
Amgen					Assay Description The assay involves the phosphorylation of a biotinylated substrate and the detection of this phosphorylation after the addition of a streptavidin-all...				J Med Chem 51: 1681-94 (2008) Article DOI: 10.1021/jm7010996 BindingDB Entry DOI: 10.7270/Q2Q81BCB
					More data for this Ligand-Target Pair
Angiopoietin-1 receptor (Homo sapiens (Human))	BDBM26387 (Aminopyrimidine amide, 33 | N-{4-ethyl-3-[(2-{[4-(...) Show SMILES CCc1ccc(NC(=O)c2ccc3OC(F)(F)Oc3c2)cc1C(=O)Nc1cnc(Nc2ccc(cc2)N2CCN(C)CC2)nc1 Show InChI InChI=1S/C32H31F2N7O4/c1-3-20-4-6-23(37-29(42)21-5-11-27-28(16-21)45-32(33,34)44-27)17-26(20)30(43)38-24-18-35-31(36-19-24)39-22-7-9-25(10-8-22)41-14-12-40(2)13-15-41/h4-11,16-19H,3,12-15H2,1-2H3,(H,37,42)(H,38,43)(H,35,36,39)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Amgen					Assay Description The assay involves the phosphorylation of a biotinylated substrate and the detection of this phosphorylation after the addition of a streptavidin-all...				J Med Chem 51: 1681-94 (2008) Article DOI: 10.1021/jm7010996 BindingDB Entry DOI: 10.7270/Q2Q81BCB
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK3 (Homo sapiens (Human))	BDBM26387 (Aminopyrimidine amide, 33 | N-{4-ethyl-3-[(2-{[4-(...) Show SMILES CCc1ccc(NC(=O)c2ccc3OC(F)(F)Oc3c2)cc1C(=O)Nc1cnc(Nc2ccc(cc2)N2CCN(C)CC2)nc1 Show InChI InChI=1S/C32H31F2N7O4/c1-3-20-4-6-23(37-29(42)21-5-11-27-28(16-21)45-32(33,34)44-27)17-26(20)30(43)38-24-18-35-31(36-19-24)39-22-7-9-25(10-8-22)41-14-12-40(2)13-15-41/h4-11,16-19H,3,12-15H2,1-2H3,(H,37,42)(H,38,43)(H,35,36,39)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Amgen					Assay Description The assay involves the phosphorylation of a biotinylated substrate and the detection of this phosphorylation after the addition of a streptavidin-all...				J Med Chem 51: 1681-94 (2008) Article DOI: 10.1021/jm7010996 BindingDB Entry DOI: 10.7270/Q2Q81BCB
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM26387 (Aminopyrimidine amide, 33 | N-{4-ethyl-3-[(2-{[4-(...) Show SMILES CCc1ccc(NC(=O)c2ccc3OC(F)(F)Oc3c2)cc1C(=O)Nc1cnc(Nc2ccc(cc2)N2CCN(C)CC2)nc1 Show InChI InChI=1S/C32H31F2N7O4/c1-3-20-4-6-23(37-29(42)21-5-11-27-28(16-21)45-32(33,34)44-27)17-26(20)30(43)38-24-18-35-31(36-19-24)39-22-7-9-25(10-8-22)41-14-12-40(2)13-15-41/h4-11,16-19H,3,12-15H2,1-2H3,(H,37,42)(H,38,43)(H,35,36,39)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	233	n/a	n/a	n/a	n/a	n/a	n/a
Amgen					Assay Description In vitro kinase assays were done to establish IC50 values against recombinant enzymes using homogeneous time-resolved fluorescence (HTRF) assay. For ...				J Med Chem 51: 1681-94 (2008) Article DOI: 10.1021/jm7010996 BindingDB Entry DOI: 10.7270/Q2Q81BCB
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM26387 (Aminopyrimidine amide, 33 | N-{4-ethyl-3-[(2-{[4-(...) Show SMILES CCc1ccc(NC(=O)c2ccc3OC(F)(F)Oc3c2)cc1C(=O)Nc1cnc(Nc2ccc(cc2)N2CCN(C)CC2)nc1 Show InChI InChI=1S/C32H31F2N7O4/c1-3-20-4-6-23(37-29(42)21-5-11-27-28(16-21)45-32(33,34)44-27)17-26(20)30(43)38-24-18-35-31(36-19-24)39-22-7-9-25(10-8-22)41-14-12-40(2)13-15-41/h4-11,16-19H,3,12-15H2,1-2H3,(H,37,42)(H,38,43)(H,35,36,39)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Amgen					Assay Description The assay involves the phosphorylation of a biotinylated substrate and the detection of this phosphorylation after the addition of a streptavidin-all...				J Med Chem 51: 1681-94 (2008) Article DOI: 10.1021/jm7010996 BindingDB Entry DOI: 10.7270/Q2Q81BCB
					More data for this Ligand-Target Pair