BDBM50502305 CHEMBL4443908

SMILES: COc1ccc(cc1)C(=O)Nc1c[nH]c2ncc(cc12)-c1ccc(OC)c(OC)c1

InChI Key: InChIKey=IZSNKSLNXHIUPV-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50502305   

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
AP2-associated protein kinase 1 (Homo sapiens (Human))	BDBM50502305 (CHEMBL4443908) Show SMILES COc1ccc(cc1)C(=O)Nc1c[nH]c2ncc(cc12)-c1ccc(OC)c(OC)c1 Show InChI InChI=1S/C23H21N3O4/c1-28-17-7-4-14(5-8-17)23(27)26-19-13-25-22-18(19)10-16(12-24-22)15-6-9-20(29-2)21(11-15)30-3/h4-13H,1-3H3,(H,24,25)(H,26,27)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	72	n/a	n/a	n/a	n/a	n/a	n/a
KU Leuven Curated by ChEMBL					Assay Description Displacement of tracer 222 from GST-tagged recombinant human AAK1 catalytic domain (1 to 510 amino acids) expressed in insect cells shaken for 30 sec...				J Med Chem 62: 5810-5831 (2019) Article DOI: 10.1021/acs.jmedchem.9b00136
					More data for this Ligand-Target Pair