BDBM50262713 4-(3-methoxy-phenyl)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-8-carboxylic acid::CHEMBL477345

SMILES: COc1cccc(c1)[C@H]1Nc2ccc(cc2[C@@H]2C=CC[C@H]12)C(O)=O

InChI Key: InChIKey=JRAQFPDPZOUMRM-JTDSTZFVSA-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 = 50262713   

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
Calmodulin-sensitive adenylate cyclase (Bacillus anthracis)	BDBM50262713 (4-(3-methoxy-phenyl)-3a,4,5,9b-tetrahydro-3H-cyclo...) Show SMILES COc1cccc(c1)[C@H]1Nc2ccc(cc2[C@@H]2C=CC[C@H]12)C(O)=O |r,c:19| Show InChI InChI=1S/C20H19NO3/c1-24-14-5-2-4-12(10-14)19-16-7-3-6-15(16)17-11-13(20(22)23)8-9-18(17)21-19/h2-6,8-11,15-16,19,21H,7H2,1H3,(H,22,23)/t15-,16+,19-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.80E+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)	BDBM50262713 (4-(3-methoxy-phenyl)-3a,4,5,9b-tetrahydro-3H-cyclo...) Show SMILES COc1cccc(c1)[C@H]1Nc2ccc(cc2[C@@H]2C=CC[C@H]12)C(O)=O |r,c:19| Show InChI InChI=1S/C20H19NO3/c1-24-14-5-2-4-12(10-14)19-16-7-3-6-15(16)17-11-13(20(22)23)8-9-18(17)21-19/h2-6,8-11,15-16,19,21H,7H2,1H3,(H,22,23)/t15-,16+,19-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.73E+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