BDBM50538903 CHEMBL4635935

SMILES: COc1cccc(c1)-c1ccc2nsc(N3CCOCC3)c2n1

InChI Key: InChIKey=OMPRLFATDTUSCC-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 = 50538903   

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
Serine/threonine-protein kinase GAK (Homo sapiens (Human))	BDBM50538903 (CHEMBL4635935) Show SMILES COc1cccc(c1)-c1ccc2nsc(N3CCOCC3)c2n1 Show InChI InChI=1S/C17H17N3O2S/c1-21-13-4-2-3-12(11-13)14-5-6-15-16(18-14)17(23-19-15)20-7-9-22-10-8-20/h2-6,11H,7-10H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	136	n/a	n/a	n/a	n/a	n/a	n/a
KU Leuven Curated by ChEMBL					Assay Description Inhibition of tracer 222 binding to recombinant human GST-tagged GAK (1 to 329 residues) expressed in insect cells incubated for 1 hr by Lanthascreen...				Bioorg Med Chem 28: (2020)
					More data for this Ligand-Target Pair