BDBM45405 6-[(4-chloranyl-2,5-dimethoxy-phenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid::6-[(4-chloro-2,5-dimethoxy-phenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid::6-[(4-chloro-2,5-dimethoxyanilino)-oxomethyl]-1-cyclohex-3-enecarboxylic acid::6-[(4-chloro-2,5-dimethoxyphenyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid::6-{[(4-chloro-2,5-dimethoxyphenyl)amino]carbonyl}-3-cyclohexene-1-carboxylic acid::MLS000088563::SMR000071846::cid_3246787

SMILES COc1cc(NC(=O)C2CC=CCC2C(O)=O)c(OC)cc1Cl

InChI Key InChIKey=SCRJBRSRHBQGTB-UHFFFAOYSA-N

Data  3 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 3 hits for monomerid = 45405   

TargetCoagulation factor XII(Homo sapiens (Human))
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM45405(6-[(4-chloranyl-2,5-dimethoxy-phenyl)carbamoyl]cyc...)
Affinity DataIC50: >5.00E+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
TargetProcathepsin L(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM45405(6-[(4-chloranyl-2,5-dimethoxy-phenyl)carbamoyl]cyc...)
Affinity DataIC50: >5.96E+4nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetM17 leucyl aminopeptidase(Plasmodium falciparum 3D7)
Srmlsc

Curated by PubChem BioAssay
LigandPNGBDBM45405(6-[(4-chloranyl-2,5-dimethoxy-phenyl)carbamoyl]cyc...)
Affinity DataIC50:  5.40E+3nMAssay Description:Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay