BDBM50171030 4-{3-[2-Hydroxy-1-hydroxymethyl-2-(4-nitro-phenyl)-ethyl]-thioureido}-benzenesulfonamide::CHEMBL413357

SMILES NS(=O)(=O)c1ccc(NC(=[SH+])[N-]C(CO)C(O)c2ccc(cc2)[N+]([O-])=O)cc1

InChI Key InChIKey=AULVCRIXDUXOJD-UHFFFAOYSA-N

Data  3 KI

  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 = 50171030   

TargetCarbonic anhydrase 12(Homo sapiens (Human))
Universita Degli Studi

Curated by ChEMBL
LigandPNGBDBM50171030(4-{3-[2-Hydroxy-1-hydroxymethyl-2-(4-nitro-phenyl)...)
Affinity DataKi:  24nMAssay Description:Inhibitory activity against catalytic domain of human carbonic anhydrase XIIMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 2(Homo sapiens (Human))
Universita Degli Studi

Curated by ChEMBL
LigandPNGBDBM50171030(4-{3-[2-Hydroxy-1-hydroxymethyl-2-(4-nitro-phenyl)...)
Affinity DataKi:  27nMAssay Description:Inhibitory activity against human carbonic anhydrase IIMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarbonic anhydrase 1(Homo sapiens (Human))
Universita Degli Studi

Curated by ChEMBL
LigandPNGBDBM50171030(4-{3-[2-Hydroxy-1-hydroxymethyl-2-(4-nitro-phenyl)...)
Affinity DataKi:  135nMAssay Description:Inhibitory activity against human carbonic anhydrase IMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed