Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Calmodulin-sensitive adenylate cyclase' and Ligand = 'BDBM50262712'   

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)	BDBM50262712 (3-[(9-oxo-9Hfluorene-1-carbonyl)-amino]-benzoic ac...) Show SMILES OC(=O)c1cccc(NC(=O)c2cccc3-c4ccccc4C(=O)c23)c1 Show InChI InChI=1S/C21H13NO4/c23-19-16-8-2-1-7-14(16)15-9-4-10-17(18(15)19)20(24)22-13-6-3-5-12(11-13)21(25)26/h1-11H,(H,22,24)(H,25,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.64E+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
Calmodulin-sensitive adenylate cyclase (Bacillus anthracis)	BDBM50262712 (3-[(9-oxo-9Hfluorene-1-carbonyl)-amino]-benzoic ac...) Show SMILES OC(=O)c1cccc(NC(=O)c2cccc3-c4ccccc4C(=O)c23)c1 Show InChI InChI=1S/C21H13NO4/c23-19-16-8-2-1-7-14(16)15-9-4-10-17(18(15)19)20(24)22-13-6-3-5-12(11-13)21(25)26/h1-11H,(H,22,24)(H,25,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Medical Branch Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis edema factor-induced cytotoxicity in mouse RAW264.7 cells assessed as LDH release after 4 hrs				Bioorg Med Chem 16: 7225-33 (2008) Article DOI: 10.1016/j.bmc.2008.06.036 BindingDB Entry DOI: 10.7270/Q2R2116M
					More data for this Ligand-Target Pair
Calmodulin-sensitive adenylate cyclase (Bacillus anthracis)	BDBM50262712 (3-[(9-oxo-9Hfluorene-1-carbonyl)-amino]-benzoic ac...) Show SMILES OC(=O)c1cccc(NC(=O)c2cccc3-c4ccccc4C(=O)c23)c1 Show InChI InChI=1S/C21H13NO4/c23-19-16-8-2-1-7-14(16)15-9-4-10-17(18(15)19)20(24)22-13-6-3-5-12(11-13)21(25)26/h1-11H,(H,22,24)(H,25,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.83E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Texas Medical Branch Curated by ChEMBL					Assay Description Inhibition of Bacillus anthracis edema factor-induced cAMP secretion in mouse RAW264.7 cells after 4 hrs by ELISA				Bioorg Med Chem 16: 7225-33 (2008) Article DOI: 10.1016/j.bmc.2008.06.036 BindingDB Entry DOI: 10.7270/Q2R2116M
					More data for this Ligand-Target Pair