BDBM50288870 2-(2-{2-[2-(4-Sulfamoyl-benzoylamino)-acetylamino]-acetylamino}-acetylamino)-hexanoic acid::CHEMBL2371090

SMILES CCCC[C@H](NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccc(cc1)S(N)(=O)=O)C(O)=O

InChI Key InChIKey=FDSLQEJWWLSOPO-AWEZNQCLSA-N

Data  2 Kd  1 Koff  1 Kon

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 4 hits for monomerid = 50288870   

TargetCarbonic anhydrase 2(Homo sapiens (Human))
TBA

Curated by ChEMBL
LigandPNGBDBM50288870(2-(2-{2-[2-(4-Sulfamoyl-benzoylamino)-acetylamino]...)
Show SMILES CCCC[C@H](NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccc(cc1)S(N)(=O)=O)C(O)=O
Show InChI InChI=1S/C19H27N5O8S/c1-2-3-4-14(19(29)30)24-17(27)11-22-15(25)9-21-16(26)10-23-18(28)12-5-7-13(8-6-12)33(20,31)32/h5-8,14H,2-4,9-11H2,1H3,(H,21,26)(H,22,25)(H,23,28)(H,24,27)(H,29,30)(H2,20,31,32)/t14-/m0/s1
Affinity DataKon:  0.0930M-1s-1Assay Description:Kinetic constant for binding human carbonic anhydrase IIMore data for this Ligand-Target Pair
In DepthDetails Article
TargetCarbonic anhydrase 2(Homo sapiens (Human))
TBA

Curated by ChEMBL
LigandPNGBDBM50288870(2-(2-{2-[2-(4-Sulfamoyl-benzoylamino)-acetylamino]...)
Show SMILES CCCC[C@H](NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccc(cc1)S(N)(=O)=O)C(O)=O
Show InChI InChI=1S/C19H27N5O8S/c1-2-3-4-14(19(29)30)24-17(27)11-22-15(25)9-21-16(26)10-23-18(28)12-5-7-13(8-6-12)33(20,31)32/h5-8,14H,2-4,9-11H2,1H3,(H,21,26)(H,22,25)(H,23,28)(H,24,27)(H,29,30)(H2,20,31,32)/t14-/m0/s1
Affinity DataKoff:  4.20E+5s-1Assay Description:Kinetic constant for binding human carbonic anhydrase II (Kon=Kd x Koff)More data for this Ligand-Target Pair
In DepthDetails Article
TargetCarbonic anhydrase 2(Homo sapiens (Human))
TBA

Curated by ChEMBL
LigandPNGBDBM50288870(2-(2-{2-[2-(4-Sulfamoyl-benzoylamino)-acetylamino]...)
Show SMILES CCCC[C@H](NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccc(cc1)S(N)(=O)=O)C(O)=O
Show InChI InChI=1S/C19H27N5O8S/c1-2-3-4-14(19(29)30)24-17(27)11-22-15(25)9-21-16(26)10-23-18(28)12-5-7-13(8-6-12)33(20,31)32/h5-8,14H,2-4,9-11H2,1H3,(H,21,26)(H,22,25)(H,23,28)(H,24,27)(H,29,30)(H2,20,31,32)/t14-/m0/s1
Affinity DataKd:  190nMAssay Description:Kinetic constant for binding human carbonic anhydrase II (Kon=Kd x Koff)More data for this Ligand-Target Pair
In DepthDetails Article
TargetCarbonic anhydrase 2(Homo sapiens (Human))
TBA

Curated by ChEMBL
LigandPNGBDBM50288870(2-(2-{2-[2-(4-Sulfamoyl-benzoylamino)-acetylamino]...)
Show SMILES CCCC[C@H](NC(=O)CNC(=O)CNC(=O)CNC(=O)c1ccc(cc1)S(N)(=O)=O)C(O)=O
Show InChI InChI=1S/C19H27N5O8S/c1-2-3-4-14(19(29)30)24-17(27)11-22-15(25)9-21-16(26)10-23-18(28)12-5-7-13(8-6-12)33(20,31)32/h5-8,14H,2-4,9-11H2,1H3,(H,21,26)(H,22,25)(H,23,28)(H,24,27)(H,29,30)(H2,20,31,32)/t14-/m0/s1
Affinity DataKd:  220nMAssay Description:Kinetic constant for binding human carbonic anhydrase IIMore data for this Ligand-Target Pair
In DepthDetails Article