BindingDB PrimarySearch

BDBM50341376 3-(2,6-dichlorophenyl)-7-(4-(2-(diethylamino)ethoxy)phenylamino)-1-methyl-3,4-dihydropyrimido[4,5-d]pyrimidin-2(1H)-one::3-(2,6-dichlorophenyl)-7-({4-[2-(diethylamino)ethoxy]phenyl}amino)-1-methyl-3,4-dihydropyrimido[4,5-d]pyrimidin-2(1H)-one::CHEMBL1234002

SMILES: CCN(CC)CCOc1ccc(Nc2ncc3CN(C(=O)N(C)c3n2)c2c(Cl)cccc2Cl)cc1

InChI Key: InChIKey=LQYPBKQMDVWUGO-UHFFFAOYSA-N

Data: 2 Kd

PDB links: 2 PDB IDs match this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50341376
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50341376 (3-(2,6-dichlorophenyl)-7-(4-(2-(diethylamino)ethox...) Show SMILES Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Patents	Article PubMed	n/a	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a
Roche Palo Alto LLC Curated by ChEMBL					Assay Description Inhibition of p38alpha				J Med Chem 54: 2255-65 (2011) Article DOI: 10.1021/jm101423y BindingDB Entry DOI: 10.7270/Q20P109X
Roche Palo Alto LLC Curated by ChEMBL					More data for this Ligand-Target Pair
Tyrosine-protein kinase Lck (Homo sapiens (Human))	BDBM50341376 (3-(2,6-dichlorophenyl)-7-(4-(2-(diethylamino)ethox...) Show SMILES Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Patents	PDB Article PubMed	n/a	n/a	n/a	0.200	n/a	n/a	n/a	n/a	n/a
Roche Palo Alto LLC Curated by ChEMBL					Assay Description Inhibition of LCK				J Med Chem 54: 2255-65 (2011) Article DOI: 10.1021/jm101423y BindingDB Entry DOI: 10.7270/Q20P109X
Roche Palo Alto LLC Curated by ChEMBL					More data for this Ligand-Target Pair				3D Structure (crystal)