Compile Data Set for Download or QSAR
Found 20 of ic50 for UniProtKB: P23280
TargetCarbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9(Homo sapiens (Human))
Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL
LigandPNGBDBM50229834(CHEMBL328270)
Show SMILES COC(=O)CCCCC(=O)Nc1nnc(s1)S(N)(=O)=O
Show InChI InChI=1S/C9H14N4O5S2/c1-18-7(15)5-3-2-4-6(14)11-8-12-13-9(19-8)20(10,16)17/h2-5H2,1H3,(H2,10,16,17)(H,11,12,14)
Affinity DataIC50: 230nMAssay Description:Inhibition of Carbonic anhydrase enzyme in rabbitsMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9(Homo sapiens (Human))
Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL
LigandPNGBDBM50229838(CHEMBL88183)
Show SMILES CCCCCOC(=O)CCC(=O)\N=c1\sc(nn1C)S(N)(=O)=O
Show InChI InChI=1S/C12H20N4O5S2/c1-3-4-5-8-21-10(18)7-6-9(17)14-11-16(2)15-12(22-11)23(13,19)20/h3-8H2,1-2H3,(H2,13,19,20)/b14-11+
Affinity DataIC50: 310nMAssay Description:Inhibition of Carbonic anhydrase enzyme in rabbitsMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9(Homo sapiens (Human))
Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL
LigandPNGBDBM50229841(CHEMBL420799)
Show SMILES CCC(C)OC(=O)CCC(=O)Nc1nnc(s1)S(N)(=O)=O
Show InChI InChI=1S/C10H16N4O5S2/c1-3-6(2)19-8(16)5-4-7(15)12-9-13-14-10(20-9)21(11,17)18/h6H,3-5H2,1-2H3,(H2,11,17,18)(H,12,13,15)
Affinity DataIC50: 370nMAssay Description:Inhibition of Carbonic anhydrase enzyme in rabbitsMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9(Homo sapiens (Human))
Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL
LigandPNGBDBM50229842(CHEMBL90119)
Show SMILES CCCCCOC(=O)CCC(=O)Nc1nnc(s1)S(N)(=O)=O
Show InChI InChI=1S/C11H18N4O5S2/c1-2-3-4-7-20-9(17)6-5-8(16)13-10-14-15-11(21-10)22(12,18)19/h2-7H2,1H3,(H2,12,18,19)(H,13,14,16)
Affinity DataIC50: 390nMAssay Description:Inhibition of Carbonic anhydrase enzyme in rabbitsMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9(Homo sapiens (Human))
Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL
LigandPNGBDBM10880(AZA | AZA2 | AZM acetazolamide | Acerazolamide, AA...)
Show SMILES CC(=O)Nc1nnc(s1)S(N)(=O)=O
Show InChI InChI=1S/C4H6N4O3S2/c1-2(9)6-3-7-8-4(12-3)13(5,10)11/h1H3,(H2,5,10,11)(H,6,7,9)
Affinity DataIC50: 440nMAssay Description:Inhibition of Carbonic anhydrase enzyme in rabbitsMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9(Homo sapiens (Human))
Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL
LigandPNGBDBM50212309(CHEMBL91302)
Show SMILES NCCCCC(=O)Nc1nnc(s1)S(N)(=O)=O
Show InChI InChI=1S/C7H13N5O3S2/c8-4-2-1-3-5(13)10-6-11-12-7(16-6)17(9,14)15/h1-4,8H2,(H2,9,14,15)(H,10,11,13)
Affinity DataIC50: 440nMAssay Description:Inhibition of Carbonic anhydrase enzyme in rabbitsMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9(Homo sapiens (Human))
Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL
LigandPNGBDBM50229847(CHEMBL91512)
Show SMILES COC(=O)CCC(=O)\N=c1\sc(nn1C)S(N)(=O)=O
Show InChI InChI=1S/C8H12N4O5S2/c1-12-7(18-8(11-12)19(9,15)16)10-5(13)3-4-6(14)17-2/h3-4H2,1-2H3,(H2,9,15,16)/b10-7+
Affinity DataIC50: 450nMAssay Description:Inhibition of Carbonic anhydrase enzyme in rabbitsMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9(Homo sapiens (Human))
Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL
LigandPNGBDBM50229846(CHEMBL264307)
Show SMILES NS(=O)(=O)c1nnc(NC(=O)CCCCCCCC(O)=O)s1
Show InChI InChI=1S/C11H18N4O5S2/c12-22(19,20)11-15-14-10(21-11)13-8(16)6-4-2-1-3-5-7-9(17)18/h1-7H2,(H,17,18)(H2,12,19,20)(H,13,14,16)
Affinity DataIC50: 480nMAssay Description:Inhibition of Carbonic anhydrase enzyme in rabbitsMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9(Homo sapiens (Human))
Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL
LigandPNGBDBM50229839(CHEMBL91622)
Show SMILES CCCCCCCCCCCCOC(=O)CCC(=O)Nc1nnc(s1)S(N)(=O)=O
Show InChI InChI=1S/C18H32N4O5S2/c1-2-3-4-5-6-7-8-9-10-11-14-27-16(24)13-12-15(23)20-17-21-22-18(28-17)29(19,25)26/h2-14H2,1H3,(H2,19,25,26)(H,20,21,23)
Affinity DataIC50: 520nMAssay Description:Inhibition of Carbonic anhydrase enzyme in rabbitsMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9(Homo sapiens (Human))
Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL
LigandPNGBDBM50229845(CHEMBL91517)
Show SMILES NS(=O)(=O)c1nnc(NC(=O)CCCC(O)=O)s1
Show InChI InChI=1S/C7H10N4O5S2/c8-18(15,16)7-11-10-6(17-7)9-4(12)2-1-3-5(13)14/h1-3H2,(H,13,14)(H2,8,15,16)(H,9,10,12)
Affinity DataIC50: 520nMAssay Description:Inhibition of Carbonic anhydrase enzyme in rabbitsMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9(Homo sapiens (Human))
Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL
LigandPNGBDBM50229835(CHEMBL90857)
Show SMILES NS(=O)(=O)c1nnc(NC(=O)CCCCC(O)=O)s1
Show InChI InChI=1S/C8H12N4O5S2/c9-19(16,17)8-12-11-7(18-8)10-5(13)3-1-2-4-6(14)15/h1-4H2,(H,14,15)(H2,9,16,17)(H,10,11,13)
Affinity DataIC50: 520nMAssay Description:Inhibition of Carbonic anhydrase enzyme in rabbitsMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9(Homo sapiens (Human))
Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL
LigandPNGBDBM50229836(CHEMBL92500)
Show SMILES COC(=O)CCC(=O)Nc1nnc(s1)S(N)(=O)=O
Show InChI InChI=1S/C7H10N4O5S2/c1-16-5(13)3-2-4(12)9-6-10-11-7(17-6)18(8,14)15/h2-3H2,1H3,(H2,8,14,15)(H,9,10,12)
Affinity DataIC50: 550nMAssay Description:Inhibition of Carbonic anhydrase enzyme in rabbitsMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9(Homo sapiens (Human))
Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL
LigandPNGBDBM50185303(CHEMBL88115)
Show SMILES NS(=O)(=O)c1nnc(NC(=O)CCC(O)=O)s1
Show InChI InChI=1S/C6H8N4O5S2/c7-17(14,15)6-10-9-5(16-6)8-3(11)1-2-4(12)13/h1-2H2,(H,12,13)(H2,7,14,15)(H,8,9,11)
Affinity DataIC50: 550nMAssay Description:Inhibition of Carbonic anhydrase enzyme in rabbitsMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9(Homo sapiens (Human))
Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL
LigandPNGBDBM50229843(CHEMBL91131)
Show SMILES CCOC(=O)CCC(=O)Nc1nnc(s1)S(N)(=O)=O
Show InChI InChI=1S/C8H12N4O5S2/c1-2-17-6(14)4-3-5(13)10-7-11-12-8(18-7)19(9,15)16/h2-4H2,1H3,(H2,9,15,16)(H,10,11,13)
Affinity DataIC50: 730nMAssay Description:Inhibition of Carbonic anhydrase enzyme in rabbitsMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9(Homo sapiens (Human))
Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL
LigandPNGBDBM50229844(CHEMBL328566)
Show SMILES COC(=O)CCCCCCCC(=O)Nc1nnc(s1)S(N)(=O)=O
Show InChI InChI=1S/C12H20N4O5S2/c1-21-10(18)8-6-4-2-3-5-7-9(17)14-11-15-16-12(22-11)23(13,19)20/h2-8H2,1H3,(H2,13,19,20)(H,14,15,17)
Affinity DataIC50: 910nMAssay Description:Inhibition of Carbonic anhydrase enzyme in rabbitsMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9(Homo sapiens (Human))
Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL
LigandPNGBDBM50229837(CHEMBL89489)
Show SMILES COC(=O)CCCC(=O)Nc1nnc(s1)S(N)(=O)=O
Show InChI InChI=1S/C8H12N4O5S2/c1-17-6(14)4-2-3-5(13)10-7-11-12-8(18-7)19(9,15)16/h2-4H2,1H3,(H2,9,15,16)(H,10,11,13)
Affinity DataIC50: 910nMAssay Description:Inhibition of Carbonic anhydrase enzyme in rabbitsMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9(Homo sapiens (Human))
Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL
LigandPNGBDBM50229840(CHEMBL329625)
Show SMILES COC(=O)CC(=O)Nc1nnc(s1)S(N)(=O)=O
Show InChI InChI=1S/C6H8N4O5S2/c1-15-4(12)2-3(11)8-5-9-10-6(16-5)17(7,13)14/h2H2,1H3,(H2,7,13,14)(H,8,9,11)
Affinity DataIC50: 940nMAssay Description:Inhibition of Carbonic anhydrase enzyme in rabbitsMore data for this Ligand-Target Pair
TargetCarbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9(Homo sapiens (Human))
Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL
LigandPNGBDBM50028010(AD-810 | CHEBI:10127 | CI-912 | PD-110843 | Zonegr...)
Show SMILES OS(=N)(=O)Cc1noc2ccccc12
Show InChI InChI=1S/C8H8N2O3S/c9-14(11,12)5-7-6-3-1-2-4-8(6)13-10-7/h1-4H,5H2,(H2,9,11,12)
Affinity DataIC50: 1.86E+3nMAssay Description:Inhibition of carbonic anhydrase (unknown origin)More data for this Ligand-Target Pair
TargetCarbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9(Homo sapiens (Human))
Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL
LigandPNGBDBM50028011(CHEMBL3360810)
Show SMILES Cc1c(sc2sc(c(-c3ccccc3)c12)-c1ccc(C#N)c(=O)[nH]1)-c1ccc(C(O)=O)c(=O)[nH]1
Show InChI InChI=1S/C25H15N3O4S2/c1-12-18-19(13-5-3-2-4-6-13)21(17-9-7-14(11-26)22(29)27-17)34-25(18)33-20(12)16-10-8-15(24(31)32)23(30)28-16/h2-10H,1H3,(H,27,29)(H,28,30)(H,31,32)
Affinity DataIC50: 2.70E+5nMAssay Description:Inhibition of carbonic anhydrase (unknown origin)More data for this Ligand-Target Pair
TargetCarbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9(Homo sapiens (Human))
Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL
LigandPNGBDBM50028012(CHEMBL3360801)
Show SMILES CC(=C(C#N)C#N)c1sc2sc(C(C)=C(C#N)C#N)c(-c3ccccc3)c2c1C
Show InChI InChI=1S/C23H14N4S2/c1-13(17(9-24)10-25)21-15(3)19-20(16-7-5-4-6-8-16)22(29-23(19)28-21)14(2)18(11-26)12-27/h4-8H,1-3H3
Affinity DataIC50: 4.42E+5nMAssay Description:Inhibition of carbonic anhydrase (unknown origin)More data for this Ligand-Target Pair