BDBM50243792 3-(1H-indol-5-yl)-5,5-dimethylcyclohex-2-enone::CHEMBL503247

SMILES: CC1(C)CC(=O)C=C(C1)c1ccc2[nH]ccc2c1

InChI Key: InChIKey=RDXMMFIPOYJDQM-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50243792   

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)	BDBM50243792 (3-(1H-indol-5-yl)-5,5-dimethylcyclohex-2-enone | C...) Show SMILES CC1(C)CC(=O)C=C(C1)c1ccc2[nH]ccc2c1 |c:6| Show InChI InChI=1S/C16H17NO/c1-16(2)9-13(8-14(18)10-16)11-3-4-15-12(7-11)5-6-17-15/h3-8,17H,9-10H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
The University of Texas Medical Branch Curated by ChEMBL					Assay Description Inhibition of Bacilus anthracis edema factor-induced edema in RAW264.7 mouse macrophages by cAMP-specific ELISA				Bioorg Med Chem Lett 18: 4215-8 (2008) Article DOI: 10.1016/j.bmcl.2008.05.059 BindingDB Entry DOI: 10.7270/Q29G5MMN
					More data for this Ligand-Target Pair