BDBM50420543 CHEMBL2087011

SMILES: OCC(=O)Nc1nnc(s1)-c1ccc(cc1)C(O)=O

InChI Key: InChIKey=DRKGAPOADLHHHK-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 = 50420543   

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
Casein kinase II subunit alpha (Homo sapiens (Human))	BDBM50420543 (CHEMBL2087011) Show SMILES OCC(=O)Nc1nnc(s1)-c1ccc(cc1)C(O)=O Show InChI InChI=1S/C11H9N3O4S/c15-5-8(16)12-11-14-13-9(19-11)6-1-3-7(4-2-6)10(17)18/h1-4,15H,5H2,(H,17,18)(H,12,14,16)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Competitive inhibition of GST fused human CK2alpha expressed in Escherichia coli BL21 after 10 mins in presence of ATP				J Med Chem 55: 2899-903 (2012) Article DOI: 10.1021/jm2015167 BindingDB Entry DOI: 10.7270/Q2445NRV
					More data for this Ligand-Target Pair
Casein kinase II alpha' (Homo sapiens (Human))	BDBM50420543 (CHEMBL2087011) Show SMILES OCC(=O)Nc1nnc(s1)-c1ccc(cc1)C(O)=O Show InChI InChI=1S/C11H9N3O4S/c15-5-8(16)12-11-14-13-9(19-11)6-1-3-7(4-2-6)10(17)18/h1-4,15H,5H2,(H,17,18)(H,12,14,16)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto University Curated by ChEMBL					Assay Description Competitive inhibition of GST fused human CK2alpha' expressed in Escherichia coli BL21 after 10 mins in presence of ATP				J Med Chem 55: 2899-903 (2012) Article DOI: 10.1021/jm2015167 BindingDB Entry DOI: 10.7270/Q2445NRV
					More data for this Ligand-Target Pair