BDBM50399648 CHEMBL2177686

SMILES: OC(=O)C(C(CC(=O)c1ccc2c(c1)[nH]c1ccccc21)c1ccccc1)C(O)=O

InChI Key: InChIKey=OBMGEBSSWPCBJP-UHFFFAOYSA-N

Data: 1 EC50

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 = 50399648   

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
3-phosphoinositide dependent protein kinase-1 (Homo sapiens (Human))	BDBM50399648 (CHEMBL2177686) Show SMILES OC(=O)C(C(CC(=O)c1ccc2c(c1)[nH]c1ccccc21)c1ccccc1)C(O)=O Show InChI InChI=1S/C24H19NO5/c26-21(13-18(14-6-2-1-3-7-14)22(23(27)28)24(29)30)15-10-11-17-16-8-4-5-9-19(16)25-20(17)12-15/h1-12,18,22,25H,13H2,(H,27,28)(H,29,30)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	3.02E+4	n/a	n/a	n/a	n/a
Saarland University Curated by ChEMBL					Assay Description Increase in thermal stability of PDK1 by differential scanning fluorimetry				J Med Chem 55: 9817-30 (2012) Article DOI: 10.1021/jm3010477 BindingDB Entry DOI: 10.7270/Q2PV6MHW
					More data for this Ligand-Target Pair