Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 359.3 BDBM50486015

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Calmodulin-sensitive adenylate cyclase (Bacillus anthracis)	BDBM50486015 (CHEMBL2203671) Show SMILES OC(=O)c1cc(NC(=O)c2cccc3-c4ccccc4C(=O)c23)ccc1O Show InChI InChI=1S/C21H13NO5/c23-17-9-8-11(10-16(17)21(26)27)22-20(25)15-7-3-6-13-12-4-1-2-5-14(12)19(24)18(13)15/h1-10,23H,(H,22,25)(H,26,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.21E+3	n/a	n/a	n/a	n/a	n/a	n/a
UTMB Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis edema toxin-mediated cAMP production in mouse RAW264.7 cells after 4 hrs by ELISA				Bioorg Med Chem 20: 368-76 (2012) Article DOI: 10.1016/j.bmc.2011.10.091 BindingDB Entry DOI: 10.7270/Q2PK0K15
					More data for this Ligand-Target Pair