BDBM50444125 CHEMBL3093150

SMILES: Nc1ncc(cc1-c1nc2ccc(cc2o1)N1CCOCC1)-c1cnn(c1)C1CCNCC1

InChI Key: InChIKey=LTLLZDPWFKVOQY-UHFFFAOYSA-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 = 50444125   

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
Beta-adrenergic receptor kinase 1 (Homo sapiens (Human))	BDBM50444125 (CHEMBL3093150) Show SMILES Nc1ncc(cc1-c1nc2ccc(cc2o1)N1CCOCC1)-c1cnn(c1)C1CCNCC1 Show InChI InChI=1S/C24H27N7O2/c25-23-20(11-16(13-27-23)17-14-28-31(15-17)18-3-5-26-6-4-18)24-29-21-2-1-19(12-22(21)33-24)30-7-9-32-10-8-30/h1-2,11-15,18,26H,3-10H2,(H2,25,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Korea Research Institute of Chemical Technology Curated by ChEMBL					Assay Description Inhibition of GRK-2 (unknown origin) preincubated with enzyme for 10 mins before adding peptide substrate and ATP measured after 1 hr by LANCE-TR-FRE...				Bioorg Med Chem Lett 23: 6711-6 (2013) Article DOI: 10.1016/j.bmcl.2013.10.036 BindingDB Entry DOI: 10.7270/Q2SX6FPP
					More data for this Ligand-Target Pair
G protein-coupled receptor kinase 5 (Homo sapiens (Human))	BDBM50444125 (CHEMBL3093150) Show SMILES Nc1ncc(cc1-c1nc2ccc(cc2o1)N1CCOCC1)-c1cnn(c1)C1CCNCC1 Show InChI InChI=1S/C24H27N7O2/c25-23-20(11-16(13-27-23)17-14-28-31(15-17)18-3-5-26-6-4-18)24-29-21-2-1-19(12-22(21)33-24)30-7-9-32-10-8-30/h1-2,11-15,18,26H,3-10H2,(H2,25,27)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	810	n/a	n/a	n/a	n/a	n/a	n/a
Korea Research Institute of Chemical Technology Curated by ChEMBL					Assay Description Inhibition of GRK-5 (unknown origin) preincubated with enzyme for 10 mins before adding peptide substrate and ATP measured after 1 hr by LANCE-TR-FRE...				Bioorg Med Chem Lett 23: 6711-6 (2013) Article DOI: 10.1016/j.bmcl.2013.10.036 BindingDB Entry DOI: 10.7270/Q2SX6FPP
					More data for this Ligand-Target Pair