BDBM33822 2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanylbenzoic acid::2-(2-morpholin-4-yl-2-oxoethyl)sulfanylbenzoic acid::2-[(2-keto-2-morpholino-ethyl)thio]benzoic acid::2-[[2-(4-morpholinyl)-2-oxoethyl]thio]benzoic acid::2-{[2-(4-morpholinyl)-2-oxoethyl]thio}benzoic acid::CHEMBL396324::MLS000862372::SMR000300822::cid_1249560

SMILES OC(=O)c1ccccc1SCC(=O)N1CCOCC1

InChI Key InChIKey=BPCHMUBDRHYFIM-UHFFFAOYSA-N

Data  1 IC50  1 Kd

  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 = 33822   

TargetPeptidyl-prolyl cis-trans isomerase FKBP1A(Homo sapiens (Human))
University Of California San Diego

Curated by ChEMBL
LigandPNGBDBM33822(2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl...)
Affinity DataKd: >3.70E+6nMAssay Description:Binding affinity to human FKBP12 expressed in Escherichia coli BL21(DE3) by isothermal titration calorimetryMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProthrombin(Homo sapiens (Human))
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM33822(2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl...)
Affinity DataIC50: >5.00E+4nMpH: 7.5 T: 2°CAssay Description:HTS was performed using 217,350 compounds of the MLSCN library individually plated into 10ul 1536 compound plates at a concentration of 2.5 mM each, ...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay