BDBM32848 (5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl) 4-methylbenzoate::(5,5-dimethyl-3-oxocyclohexen-1-yl) 4-methylbenzoate::4-methylbenzoic acid (3-keto-5,5-dimethyl-cyclohexen-1-yl) ester::4-methylbenzoic acid (5,5-dimethyl-3-oxo-1-cyclohexenyl) ester::5,5-dimethyl-3-oxo-1-cyclohexenyl 4-methylbenzenecarboxylate::MLS000326873::SMR000179463::cid_1474654

SMILES Cc1ccc(cc1)C(=O)OC1=CC(=O)CC(C)(C)C1

InChI Key InChIKey=WULVYUZAMHODCN-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 32848   

TargetCoagulation factor XII(Homo sapiens (Human))
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM32848((5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl) 4-m...)
Affinity DataIC50:  1.00E+4nMAssay Description:Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Scott L. Diamond, University of Pennsy...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetCoagulation factor XI(Homo sapiens (Human))
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM32848((5,5-dimethyl-3-oxidanylidene-cyclohexen-1-yl) 4-m...)
Affinity DataIC50:  2.29E+3nMpH: 7.4 T: 2°CAssay Description:Factor XIa (0.23 ug/mL) was incubated with Boc-Glu-Ala-Arg-AMC substrate (15 uM) in 10 uL of assay buffer for 2 hr at room temperature. Read fluoresc...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay