BindingDB logo
myBDB logout

PubMed code 25913118

Compile data set for download or QSAR
Found 95 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50082767
PNG
(CHEMBL3423266)
Show SMILES NS(=O)(=O)c1ccc(CCNCc2ccc(OCc3ccccc3)cc2)cc1
Show InChI InChI=1S/C22H24N2O3S/c23-28(25,26)22-12-8-18(9-13-22)14-15-24-16-19-6-10-21(11-7-19)27-17-20-4-2-1-3-5-20/h1-13,24H,14-17H2,(H2,23,25,26)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
2.90n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-9 preincubated for 15 mins by stopped flow CO2 hydration a...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM10884
PNG
((2S,4S)-4-(ethylamino)-2-methyl-1,1-dioxo-2H,3H,4H...)
Show SMILES CCN[C@H]1C[C@H](C)S(=O)(=O)c2sc(cc12)S(N)(=O)=O |r|
Show InChI InChI=1S/C10H16N2O4S3/c1-3-12-8-4-6(2)18(13,14)10-7(8)5-9(17-10)19(11,15)16/h5-6,8,12H,3-4H2,1-2H3,(H2,11,15,16)/t6-,8-/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

DrugBank
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents

Article
PubMed
3n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-12 preincubated for 15 mins by stopped flow CO2 hydration ...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50013792
PNG
(CHEBI:6822 | METHAZOLAMIDE | Neptazane)
Show SMILES CC(=O)\N=c1\sc(nn1C)S(N)(=O)=O
Show InChI InChI=1S/C5H8N4O3S2/c1-3(10)7-4-9(2)8-5(13-4)14(6,11)12/h1-2H3,(H2,6,11,12)/b7-4+
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
KEGG
PC cid
PC sid
UniChem
Article
PubMed
3.40n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-12 preincubated for 15 mins by stopped flow CO2 hydration ...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM10890
PNG
(1-N-(3-chloro-1H-indol-7-yl)benzene-1,4-disulfonam...)
Show SMILES NS(=O)(=O)c1ccc(cc1)S(=O)(=O)Nc1cccc2c(Cl)c[nH]c12
Show InChI InChI=1S/C14H12ClN3O4S2/c15-12-8-17-14-11(12)2-1-3-13(14)18-24(21,22)10-6-4-9(5-7-10)23(16,19)20/h1-8,17-18H,(H2,16,19,20)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
3.40n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-12 preincubated for 15 mins by stopped flow CO2 hydration ...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50082759
PNG
(CHEMBL3423268)
Show SMILES CN(C)c1ccc(CNCCc2ccc(cc2)S(N)(=O)=O)cc1
Show InChI InChI=1S/C17H23N3O2S/c1-20(2)16-7-3-15(4-8-16)13-19-12-11-14-5-9-17(10-6-14)23(18,21)22/h3-10,19H,11-13H2,1-2H3,(H2,18,21,22)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
Article
PubMed
3.5n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-9 preincubated for 15 mins by stopped flow CO2 hydration a...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM10885
PNG
((4R)-4-(ethylamino)-2-(3-methoxypropyl)-1,1-dioxo-...)
Show SMILES CCN[C@H]1CN(CCCOC)S(=O)(=O)c2sc(cc12)S(N)(=O)=O |r|
Show InChI InChI=1S/C12H21N3O5S3/c1-3-14-10-8-15(5-4-6-20-2)23(18,19)12-9(10)7-11(21-12)22(13,16)17/h7,10,14H,3-6,8H2,1-2H3,(H2,13,16,17)/t10-/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

DrugBank
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents

Article
PubMed
3.5n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-12 preincubated for 15 mins by stopped flow CO2 hydration ...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50082762
PNG
(CHEMBL3423261)
Show SMILES Cc1cccc(CNCCc2ccc(cc2)S(N)(=O)=O)c1O
Show InChI InChI=1S/C16H20N2O3S/c1-12-3-2-4-14(16(12)19)11-18-10-9-13-5-7-15(8-6-13)22(17,20)21/h2-8,18-19H,9-11H2,1H3,(H2,17,20,21)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents

Article
PubMed
3.70n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-9 preincubated for 15 mins by stopped flow CO2 hydration a...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50082760
PNG
(CHEMBL3423259)
Show SMILES NS(=O)(=O)c1ccc(CCNCc2ccccc2O)cc1
Show InChI InChI=1S/C15H18N2O3S/c16-21(19,20)14-7-5-12(6-8-14)9-10-17-11-13-3-1-2-4-15(13)18/h1-8,17-18H,9-11H2,(H2,16,19,20)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
3.90n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-9 preincubated for 15 mins by stopped flow CO2 hydration a...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50082758
PNG
(CHEMBL3423267)
Show SMILES NS(=O)(=O)c1ccc(CCNCc2cc(Cl)cc(Cl)c2O)cc1
Show InChI InChI=1S/C15H16Cl2N2O3S/c16-12-7-11(15(20)14(17)8-12)9-19-6-5-10-1-3-13(4-2-10)23(18,21)22/h1-4,7-8,19-20H,5-6,9H2,(H2,18,21,22)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
4.10n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-9 preincubated for 15 mins by stopped flow CO2 hydration a...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50082761
PNG
(CHEMBL3423260)
Show SMILES NS(=O)(=O)c1ccc(CCNCc2cc(Br)cc(Br)c2O)cc1
Show InChI InChI=1S/C15H16Br2N2O3S/c16-12-7-11(15(20)14(17)8-12)9-19-6-5-10-1-3-13(4-2-10)23(18,21)22/h1-4,7-8,19-20H,5-6,9H2,(H2,18,21,22)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
4.10n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-9 preincubated for 15 mins by stopped flow CO2 hydration a...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50082767
PNG
(CHEMBL3423266)
Show SMILES NS(=O)(=O)c1ccc(CCNCc2ccc(OCc3ccccc3)cc2)cc1
Show InChI InChI=1S/C22H24N2O3S/c23-28(25,26)22-12-8-18(9-13-22)14-15-24-16-19-6-10-21(11-7-19)27-17-20-4-2-1-3-5-20/h1-13,24H,14-17H2,(H2,23,25,26)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
4.20n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-2 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50013771
PNG
(CHEMBL3264980)
Show SMILES NS(=O)(=O)c1ccc(CCNCc2ccccc2)cc1
Show InChI InChI=1S/C15H18N2O2S/c16-20(18,19)15-8-6-13(7-9-15)10-11-17-12-14-4-2-1-3-5-14/h1-9,17H,10-12H2,(H2,16,18,19)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
4.30n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-1 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50082764
PNG
(CHEMBL3423263)
Show SMILES NS(=O)(=O)c1ccc(CCNCc2cc(Br)ccc2O)cc1
Show InChI InChI=1S/C15H17BrN2O3S/c16-13-3-6-15(19)12(9-13)10-18-8-7-11-1-4-14(5-2-11)22(17,20)21/h1-6,9,18-19H,7-8,10H2,(H2,17,20,21)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
4.30n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-9 preincubated for 15 mins by stopped flow CO2 hydration a...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50082763
PNG
(CHEMBL3423262)
Show SMILES COc1ccc(CNCCc2ccc(cc2)S(N)(=O)=O)cc1
Show InChI InChI=1S/C16H20N2O3S/c1-21-15-6-2-14(3-7-15)12-18-11-10-13-4-8-16(9-5-13)22(17,19)20/h2-9,18H,10-12H2,1H3,(H2,17,19,20)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents

Article
PubMed
4.30n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-9 preincubated for 15 mins by stopped flow CO2 hydration a...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50013771
PNG
(CHEMBL3264980)
Show SMILES NS(=O)(=O)c1ccc(CCNCc2ccccc2)cc1
Show InChI InChI=1S/C15H18N2O2S/c16-20(18,19)15-8-6-13(7-9-15)10-11-17-12-14-4-2-1-3-5-14/h1-9,17H,10-12H2,(H2,16,18,19)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
4.30n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-9 preincubated for 15 mins by stopped flow CO2 hydration a...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50082765
PNG
(CHEMBL3423264)
Show SMILES Cc1ccc(CNCCc2ccc(cc2)S(N)(=O)=O)cc1
Show InChI InChI=1S/C16H20N2O2S/c1-13-2-4-15(5-3-13)12-18-11-10-14-6-8-16(9-7-14)21(17,19)20/h2-9,18H,10-12H2,1H3,(H2,17,19,20)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
Article
PubMed
4.5n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-1 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50082765
PNG
(CHEMBL3423264)
Show SMILES Cc1ccc(CNCCc2ccc(cc2)S(N)(=O)=O)cc1
Show InChI InChI=1S/C16H20N2O2S/c1-13-2-4-15(5-3-13)12-18-11-10-14-6-8-16(9-7-14)21(17,19)20/h2-9,18H,10-12H2,1H3,(H2,17,19,20)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
Article
PubMed
4.60n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-2 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50082763
PNG
(CHEMBL3423262)
Show SMILES COc1ccc(CNCCc2ccc(cc2)S(N)(=O)=O)cc1
Show InChI InChI=1S/C16H20N2O3S/c1-21-15-6-2-14(3-7-15)12-18-11-10-13-4-8-16(9-5-13)22(17,19)20/h2-9,18H,10-12H2,1H3,(H2,17,19,20)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents

Article
PubMed
4.60n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-1 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50082760
PNG
(CHEMBL3423259)
Show SMILES NS(=O)(=O)c1ccc(CCNCc2ccccc2O)cc1
Show InChI InChI=1S/C15H18N2O3S/c16-21(19,20)14-7-5-12(6-8-14)9-10-17-11-13-3-1-2-4-15(13)18/h1-8,17-18H,9-11H2,(H2,16,19,20)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
5.30n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-1 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50082765
PNG
(CHEMBL3423264)
Show SMILES Cc1ccc(CNCCc2ccc(cc2)S(N)(=O)=O)cc1
Show InChI InChI=1S/C16H20N2O2S/c1-13-2-4-15(5-3-13)12-18-11-10-14-6-8-16(9-7-14)21(17,19)20/h2-9,18H,10-12H2,1H3,(H2,17,19,20)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
Article
PubMed
5.70n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-12 preincubated for 15 mins by stopped flow CO2 hydration ...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM10880
PNG
(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)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents

PDB
Article
PubMed
6n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-12 preincubated for 15 mins by stopped flow CO2 hydration ...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50013771
PNG
(CHEMBL3264980)
Show SMILES NS(=O)(=O)c1ccc(CCNCc2ccccc2)cc1
Show InChI InChI=1S/C15H18N2O2S/c16-20(18,19)15-8-6-13(7-9-15)10-11-17-12-14-4-2-1-3-5-14/h1-9,17H,10-12H2,(H2,16,18,19)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
6.30n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-12 preincubated for 15 mins by stopped flow CO2 hydration ...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50082766
PNG
(CHEMBL3423265)
Show SMILES NS(=O)(=O)c1ccc(CCNCc2cc(Cl)ccc2O)cc1
Show InChI InChI=1S/C15H17ClN2O3S/c16-13-3-6-15(19)12(9-13)10-18-8-7-11-1-4-14(5-2-11)22(17,20)21/h1-6,9,18-19H,7-8,10H2,(H2,17,20,21)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
6.60n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-2 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50082762
PNG
(CHEMBL3423261)
Show SMILES Cc1cccc(CNCCc2ccc(cc2)S(N)(=O)=O)c1O
Show InChI InChI=1S/C16H20N2O3S/c1-12-3-2-4-14(16(12)19)11-18-10-9-13-5-7-15(8-6-13)22(17,20)21/h2-8,18-19H,9-11H2,1H3,(H2,17,20,21)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents

Article
PubMed
7.20n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-1 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50082764
PNG
(CHEMBL3423263)
Show SMILES NS(=O)(=O)c1ccc(CCNCc2cc(Br)ccc2O)cc1
Show InChI InChI=1S/C15H17BrN2O3S/c16-13-3-6-15(19)12(9-13)10-18-8-7-11-1-4-14(5-2-11)22(17,20)21/h1-6,9,18-19H,7-8,10H2,(H2,17,20,21)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
7.60n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-2 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50013771
PNG
(CHEMBL3264980)
Show SMILES NS(=O)(=O)c1ccc(CCNCc2ccccc2)cc1
Show InChI InChI=1S/C15H18N2O2S/c16-20(18,19)15-8-6-13(7-9-15)10-11-17-12-14-4-2-1-3-5-14/h1-9,17H,10-12H2,(H2,16,18,19)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
8n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-2 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50082767
PNG
(CHEMBL3423266)
Show SMILES NS(=O)(=O)c1ccc(CCNCc2ccc(OCc3ccccc3)cc2)cc1
Show InChI InChI=1S/C22H24N2O3S/c23-28(25,26)22-12-8-18(9-13-22)14-15-24-16-19-6-10-21(11-7-19)27-17-20-4-2-1-3-5-20/h1-13,24H,14-17H2,(H2,23,25,26)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
8.5n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-12 preincubated for 15 mins by stopped flow CO2 hydration ...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50082762
PNG
(CHEMBL3423261)
Show SMILES Cc1cccc(CNCCc2ccc(cc2)S(N)(=O)=O)c1O
Show InChI InChI=1S/C16H20N2O3S/c1-12-3-2-4-14(16(12)19)11-18-10-9-13-5-7-15(8-6-13)22(17,20)21/h2-8,18-19H,9-11H2,1H3,(H2,17,20,21)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents

Article
PubMed
8.5n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-2 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50082766
PNG
(CHEMBL3423265)
Show SMILES NS(=O)(=O)c1ccc(CCNCc2cc(Cl)ccc2O)cc1
Show InChI InChI=1S/C15H17ClN2O3S/c16-13-3-6-15(19)12(9-13)10-18-8-7-11-1-4-14(5-2-11)22(17,20)21/h1-6,9,18-19H,7-8,10H2,(H2,17,20,21)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
9.5n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-12 preincubated for 15 mins by stopped flow CO2 hydration ...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50082765
PNG
(CHEMBL3423264)
Show SMILES Cc1ccc(CNCCc2ccc(cc2)S(N)(=O)=O)cc1
Show InChI InChI=1S/C16H20N2O2S/c1-13-2-4-15(5-3-13)12-18-11-10-14-6-8-16(9-7-14)21(17,19)20/h2-9,18H,10-12H2,1H3,(H2,17,19,20)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
Article
PubMed
10n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-9 preincubated for 15 mins by stopped flow CO2 hydration a...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50082759
PNG
(CHEMBL3423268)
Show SMILES CN(C)c1ccc(CNCCc2ccc(cc2)S(N)(=O)=O)cc1
Show InChI InChI=1S/C17H23N3O2S/c1-20(2)16-7-3-15(4-8-16)13-19-12-11-14-5-9-17(10-6-14)23(18,21)22/h3-10,19H,11-13H2,1-2H3,(H2,18,21,22)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
Article
PubMed
11n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-2 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50082762
PNG
(CHEMBL3423261)
Show SMILES Cc1cccc(CNCCc2ccc(cc2)S(N)(=O)=O)c1O
Show InChI InChI=1S/C16H20N2O3S/c1-12-3-2-4-14(16(12)19)11-18-10-9-13-5-7-15(8-6-13)22(17,20)21/h2-8,18-19H,9-11H2,1H3,(H2,17,20,21)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents

Article
PubMed
11n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-12 preincubated for 15 mins by stopped flow CO2 hydration ...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50082764
PNG
(CHEMBL3423263)
Show SMILES NS(=O)(=O)c1ccc(CCNCc2cc(Br)ccc2O)cc1
Show InChI InChI=1S/C15H17BrN2O3S/c16-13-3-6-15(19)12(9-13)10-18-8-7-11-1-4-14(5-2-11)22(17,20)21/h1-6,9,18-19H,7-8,10H2,(H2,17,20,21)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
11n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-12 preincubated for 15 mins by stopped flow CO2 hydration ...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50082758
PNG
(CHEMBL3423267)
Show SMILES NS(=O)(=O)c1ccc(CCNCc2cc(Cl)cc(Cl)c2O)cc1
Show InChI InChI=1S/C15H16Cl2N2O3S/c16-12-7-11(15(20)14(17)8-12)9-19-6-5-10-1-3-13(4-2-10)23(18,21)22/h1-4,7-8,19-20H,5-6,9H2,(H2,18,21,22)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
11n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-12 preincubated for 15 mins by stopped flow CO2 hydration ...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50082764
PNG
(CHEMBL3423263)
Show SMILES NS(=O)(=O)c1ccc(CCNCc2cc(Br)ccc2O)cc1
Show InChI InChI=1S/C15H17BrN2O3S/c16-13-3-6-15(19)12(9-13)10-18-8-7-11-1-4-14(5-2-11)22(17,20)21/h1-6,9,18-19H,7-8,10H2,(H2,17,20,21)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
12n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-1 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50082763
PNG
(CHEMBL3423262)
Show SMILES COc1ccc(CNCCc2ccc(cc2)S(N)(=O)=O)cc1
Show InChI InChI=1S/C16H20N2O3S/c1-21-15-6-2-14(3-7-15)12-18-11-10-13-4-8-16(9-5-13)22(17,19)20/h2-9,18H,10-12H2,1H3,(H2,17,19,20)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents

Article
PubMed
13n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-2 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50082767
PNG
(CHEMBL3423266)
Show SMILES NS(=O)(=O)c1ccc(CCNCc2ccc(OCc3ccccc3)cc2)cc1
Show InChI InChI=1S/C22H24N2O3S/c23-28(25,26)22-12-8-18(9-13-22)14-15-24-16-19-6-10-21(11-7-19)27-17-20-4-2-1-3-5-20/h1-13,24H,14-17H2,(H2,23,25,26)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
16n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-1 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50082759
PNG
(CHEMBL3423268)
Show SMILES CN(C)c1ccc(CNCCc2ccc(cc2)S(N)(=O)=O)cc1
Show InChI InChI=1S/C17H23N3O2S/c1-20(2)16-7-3-15(4-8-16)13-19-12-11-14-5-9-17(10-6-14)23(18,21)22/h3-10,19H,11-13H2,1-2H3,(H2,18,21,22)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
Article
PubMed
16n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-1 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50082766
PNG
(CHEMBL3423265)
Show SMILES NS(=O)(=O)c1ccc(CCNCc2cc(Cl)ccc2O)cc1
Show InChI InChI=1S/C15H17ClN2O3S/c16-13-3-6-15(19)12(9-13)10-18-8-7-11-1-4-14(5-2-11)22(17,20)21/h1-6,9,18-19H,7-8,10H2,(H2,17,20,21)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
16n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-9 preincubated for 15 mins by stopped flow CO2 hydration a...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50082766
PNG
(CHEMBL3423265)
Show SMILES NS(=O)(=O)c1ccc(CCNCc2cc(Cl)ccc2O)cc1
Show InChI InChI=1S/C15H17ClN2O3S/c16-13-3-6-15(19)12(9-13)10-18-8-7-11-1-4-14(5-2-11)22(17,20)21/h1-6,9,18-19H,7-8,10H2,(H2,17,20,21)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
17n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-1 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM10882
PNG
(6-ethoxy-1,3-benzothiazole-2-sulfonamide | CHEMBL1...)
Show SMILES CCOc1ccc2nc(sc2c1)S(N)(=O)=O
Show InChI InChI=1S/C9H10N2O3S2/c1-2-14-6-3-4-7-8(5-6)15-9(11-7)16(10,12)13/h3-5H,2H2,1H3,(H2,10,12,13)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
MMDB
PC cid
PC sid
PDB
UniChem

Patents

Article
PubMed
22n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-12 preincubated for 15 mins by stopped flow CO2 hydration ...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50082758
PNG
(CHEMBL3423267)
Show SMILES NS(=O)(=O)c1ccc(CCNCc2cc(Cl)cc(Cl)c2O)cc1
Show InChI InChI=1S/C15H16Cl2N2O3S/c16-12-7-11(15(20)14(17)8-12)9-19-6-5-10-1-3-13(4-2-10)23(18,21)22/h1-4,7-8,19-20H,5-6,9H2,(H2,18,21,22)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
30n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-2 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50082763
PNG
(CHEMBL3423262)
Show SMILES COc1ccc(CNCCc2ccc(cc2)S(N)(=O)=O)cc1
Show InChI InChI=1S/C16H20N2O3S/c1-21-15-6-2-14(3-7-15)12-18-11-10-13-4-8-16(9-5-13)22(17,19)20/h2-9,18H,10-12H2,1H3,(H2,17,19,20)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents

Article
PubMed
38n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-12 preincubated for 15 mins by stopped flow CO2 hydration ...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50082757
PNG
(CHEMBL3423258)
Show SMILES CN(C)c1ccc(\C=N/CCc2ccc(cc2)S(N)(=O)=O)cc1
Show InChI InChI=1S/C17H21N3O2S/c1-20(2)16-7-3-15(4-8-16)13-19-12-11-14-5-9-17(10-6-14)23(18,21)22/h3-10,13H,11-12H2,1-2H3,(H2,18,21,22)/b19-13-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
39n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-9 preincubated for 15 mins by stopped flow CO2 hydration a...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50082759
PNG
(CHEMBL3423268)
Show SMILES CN(C)c1ccc(CNCCc2ccc(cc2)S(N)(=O)=O)cc1
Show InChI InChI=1S/C17H23N3O2S/c1-20(2)16-7-3-15(4-8-16)13-19-12-11-14-5-9-17(10-6-14)23(18,21)22/h3-10,19H,11-13H2,1-2H3,(H2,18,21,22)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
Article
PubMed
43n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-12 preincubated for 15 mins by stopped flow CO2 hydration ...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50082758
PNG
(CHEMBL3423267)
Show SMILES NS(=O)(=O)c1ccc(CCNCc2cc(Cl)cc(Cl)c2O)cc1
Show InChI InChI=1S/C15H16Cl2N2O3S/c16-12-7-11(15(20)14(17)8-12)9-19-6-5-10-1-3-13(4-2-10)23(18,21)22/h1-4,7-8,19-20H,5-6,9H2,(H2,18,21,22)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
45n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-1 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50082739
PNG
(CHEMBL3421649)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C/c2ccccc2O)cc1
Show InChI InChI=1S/C15H16N2O3S/c16-21(19,20)14-7-5-12(6-8-14)9-10-17-11-13-3-1-2-4-15(13)18/h1-8,11,18H,9-10H2,(H2,16,19,20)/b17-11-
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
47n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-12 preincubated for 15 mins by stopped flow CO2 hydration ...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM10883
PNG
(4,5-dichlorobenzene-1,3-disulfonamide | CHEMBL17 |...)
Show SMILES NS(=O)(=O)c1cc(Cl)c(Cl)c(c1)S(N)(=O)=O
Show InChI InChI=1S/C6H6Cl2N2O4S2/c7-4-1-3(15(9,11)12)2-5(6(4)8)16(10,13)14/h1-2H,(H2,9,11,12)(H2,10,13,14)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
KEGG
MMDB
PC cid
PC sid
PDB
UniChem

Patents

Article
PubMed
50n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-12 preincubated for 15 mins by stopped flow CO2 hydration ...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50082761
PNG
(CHEMBL3423260)
Show SMILES NS(=O)(=O)c1ccc(CCNCc2cc(Br)cc(Br)c2O)cc1
Show InChI InChI=1S/C15H16Br2N2O3S/c16-12-7-11(15(20)14(17)8-12)9-19-6-5-10-1-3-13(4-2-10)23(18,21)22/h1-4,7-8,19-20H,5-6,9H2,(H2,18,21,22)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
86n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-12 preincubated for 15 mins by stopped flow CO2 hydration ...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50082760
PNG
(CHEMBL3423259)
Show SMILES NS(=O)(=O)c1ccc(CCNCc2ccccc2O)cc1
Show InChI InChI=1S/C15H18N2O3S/c16-21(19,20)14-7-5-12(6-8-14)9-10-17-11-13-3-1-2-4-15(13)18/h1-8,17-18H,9-11H2,(H2,16,19,20)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
91n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-12 preincubated for 15 mins by stopped flow CO2 hydration ...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50082754
PNG
(CHEMBL3423255)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C/c2cc(Cl)ccc2O)cc1
Show InChI InChI=1S/C15H15ClN2O3S/c16-13-3-6-15(19)12(9-13)10-18-8-7-11-1-4-14(5-2-11)22(17,20)21/h1-6,9-10,19H,7-8H2,(H2,17,20,21)/b18-10-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents

Article
PubMed
106n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-9 preincubated for 15 mins by stopped flow CO2 hydration a...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50082760
PNG
(CHEMBL3423259)
Show SMILES NS(=O)(=O)c1ccc(CCNCc2ccccc2O)cc1
Show InChI InChI=1S/C15H18N2O3S/c16-21(19,20)14-7-5-12(6-8-14)9-10-17-11-13-3-1-2-4-15(13)18/h1-8,17-18H,9-11H2,(H2,16,19,20)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
110n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-2 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50082753
PNG
(CHEMBL3423254)
Show SMILES Cc1ccc(\C=N/CCc2ccc(cc2)S(N)(=O)=O)cc1
Show InChI InChI=1S/C16H18N2O2S/c1-13-2-4-15(5-3-13)12-18-11-10-14-6-8-16(9-7-14)21(17,19)20/h2-9,12H,10-11H2,1H3,(H2,17,19,20)/b18-12-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents

Article
PubMed
123n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-9 preincubated for 15 mins by stopped flow CO2 hydration a...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50082739
PNG
(CHEMBL3421649)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C/c2ccccc2O)cc1
Show InChI InChI=1S/C15H16N2O3S/c16-21(19,20)14-7-5-12(6-8-14)9-10-17-11-13-3-1-2-4-15(13)18/h1-8,11,18H,9-10H2,(H2,16,19,20)/b17-11-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
138n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-9 preincubated for 15 mins by stopped flow CO2 hydration a...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50082738
PNG
(CHEMBL3423249)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C/c2cc(Br)cc(Br)c2O)cc1
Show InChI InChI=1S/C15H14Br2N2O3S/c16-12-7-11(15(20)14(17)8-12)9-19-6-5-10-1-3-13(4-2-10)23(18,21)22/h1-4,7-9,20H,5-6H2,(H2,18,21,22)/b19-9-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
163n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-9 preincubated for 15 mins by stopped flow CO2 hydration a...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50082740
PNG
(CHEMBL3423253)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C/c2cc(Br)ccc2O)cc1
Show InChI InChI=1S/C15H15BrN2O3S/c16-13-3-6-15(19)12(9-13)10-18-8-7-11-1-4-14(5-2-11)22(17,20)21/h1-6,9-10,19H,7-8H2,(H2,17,20,21)/b18-10-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
187n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-9 preincubated for 15 mins by stopped flow CO2 hydration a...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50082756
PNG
(CHEMBL3423257)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C/c2cc(Cl)cc(Cl)c2O)cc1
Show InChI InChI=1S/C15H14Cl2N2O3S/c16-12-7-11(15(20)14(17)8-12)9-19-6-5-10-1-3-13(4-2-10)23(18,21)22/h1-4,7-9,20H,5-6H2,(H2,18,21,22)/b19-9-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
190n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-9 preincubated for 15 mins by stopped flow CO2 hydration a...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50082727
PNG
(CHEMBL3423250)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C/c2ccccc2)cc1
Show InChI InChI=1S/C15H16N2O2S/c16-20(18,19)15-8-6-13(7-9-15)10-11-17-12-14-4-2-1-3-5-14/h1-9,12H,10-11H2,(H2,16,18,19)/b17-12-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
220n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-9 preincubated for 15 mins by stopped flow CO2 hydration a...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50082755
PNG
(CHEMBL3423256)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C/c2ccc(OCc3ccccc3)cc2)cc1
Show InChI InChI=1S/C22H22N2O3S/c23-28(25,26)22-12-8-18(9-13-22)14-15-24-16-19-6-10-21(11-7-19)27-17-20-4-2-1-3-5-20/h1-13,16H,14-15,17H2,(H2,23,25,26)/b24-16-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
230n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-9 preincubated for 15 mins by stopped flow CO2 hydration a...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50082669
PNG
(CHEMBL3423252)
Show SMILES COc1ccc(\C=N/CCc2ccc(cc2)S(N)(=O)=O)cc1
Show InChI InChI=1S/C16H18N2O3S/c1-21-15-6-2-14(3-7-15)12-18-11-10-13-4-8-16(9-5-13)22(17,19)20/h2-9,12H,10-11H2,1H3,(H2,17,19,20)/b18-12-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
231n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-9 preincubated for 15 mins by stopped flow CO2 hydration a...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50082756
PNG
(CHEMBL3423257)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C/c2cc(Cl)cc(Cl)c2O)cc1
Show InChI InChI=1S/C15H14Cl2N2O3S/c16-12-7-11(15(20)14(17)8-12)9-19-6-5-10-1-3-13(4-2-10)23(18,21)22/h1-4,7-9,20H,5-6H2,(H2,18,21,22)/b19-9-
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
277n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-2 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50082686
PNG
(CHEMBL3423251)
Show SMILES Cc1cccc(\C=N/CCc2ccc(cc2)S(N)(=O)=O)c1O
Show InChI InChI=1S/C16H18N2O3S/c1-12-3-2-4-14(16(12)19)11-18-10-9-13-5-7-15(8-6-13)22(17,20)21/h2-8,11,19H,9-10H2,1H3,(H2,17,20,21)/b18-11-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
295n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-9 preincubated for 15 mins by stopped flow CO2 hydration a...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50082753
PNG
(CHEMBL3423254)
Show SMILES Cc1ccc(\C=N/CCc2ccc(cc2)S(N)(=O)=O)cc1
Show InChI InChI=1S/C16H18N2O2S/c1-13-2-4-15(5-3-13)12-18-11-10-14-6-8-16(9-7-14)21(17,19)20/h2-9,12H,10-11H2,1H3,(H2,17,19,20)/b18-12-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents

Article
PubMed
308n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-1 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50082761
PNG
(CHEMBL3423260)
Show SMILES NS(=O)(=O)c1ccc(CCNCc2cc(Br)cc(Br)c2O)cc1
Show InChI InChI=1S/C15H16Br2N2O3S/c16-12-7-11(15(20)14(17)8-12)9-19-6-5-10-1-3-13(4-2-10)23(18,21)22/h1-4,7-8,19-20H,5-6,9H2,(H2,18,21,22)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
315n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-2 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50082740
PNG
(CHEMBL3423253)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C/c2cc(Br)ccc2O)cc1
Show InChI InChI=1S/C15H15BrN2O3S/c16-13-3-6-15(19)12(9-13)10-18-8-7-11-1-4-14(5-2-11)22(17,20)21/h1-6,9-10,19H,7-8H2,(H2,17,20,21)/b18-10-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
351n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-1 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50082754
PNG
(CHEMBL3423255)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C/c2cc(Cl)ccc2O)cc1
Show InChI InChI=1S/C15H15ClN2O3S/c16-13-3-6-15(19)12(9-13)10-18-8-7-11-1-4-14(5-2-11)22(17,20)21/h1-6,9-10,19H,7-8H2,(H2,17,20,21)/b18-10-
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents

Article
PubMed
365n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-2 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50082757
PNG
(CHEMBL3423258)
Show SMILES CN(C)c1ccc(\C=N/CCc2ccc(cc2)S(N)(=O)=O)cc1
Show InChI InChI=1S/C17H21N3O2S/c1-20(2)16-7-3-15(4-8-16)13-19-12-11-14-5-9-17(10-6-14)23(18,21)22/h3-10,13H,11-12H2,1-2H3,(H2,18,21,22)/b19-13-
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
374n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-2 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50082738
PNG
(CHEMBL3423249)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C/c2cc(Br)cc(Br)c2O)cc1
Show InChI InChI=1S/C15H14Br2N2O3S/c16-12-7-11(15(20)14(17)8-12)9-19-6-5-10-1-3-13(4-2-10)23(18,21)22/h1-4,7-9,20H,5-6H2,(H2,18,21,22)/b19-9-
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
377n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-2 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50082754
PNG
(CHEMBL3423255)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C/c2cc(Cl)ccc2O)cc1
Show InChI InChI=1S/C15H15ClN2O3S/c16-13-3-6-15(19)12(9-13)10-18-8-7-11-1-4-14(5-2-11)22(17,20)21/h1-6,9-10,19H,7-8H2,(H2,17,20,21)/b18-10-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents

Article
PubMed
384n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-1 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50082727
PNG
(CHEMBL3423250)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C/c2ccccc2)cc1
Show InChI InChI=1S/C15H16N2O2S/c16-20(18,19)15-8-6-13(7-9-15)10-11-17-12-14-4-2-1-3-5-14/h1-9,12H,10-11H2,(H2,16,18,19)/b17-12-
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
386n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-2 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50082739
PNG
(CHEMBL3421649)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C/c2ccccc2O)cc1
Show InChI InChI=1S/C15H16N2O3S/c16-21(19,20)14-7-5-12(6-8-14)9-10-17-11-13-3-1-2-4-15(13)18/h1-8,11,18H,9-10H2,(H2,16,19,20)/b17-11-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
393n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-1 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50082740
PNG
(CHEMBL3423253)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C/c2cc(Br)ccc2O)cc1
Show InChI InChI=1S/C15H15BrN2O3S/c16-13-3-6-15(19)12(9-13)10-18-8-7-11-1-4-14(5-2-11)22(17,20)21/h1-6,9-10,19H,7-8H2,(H2,17,20,21)/b18-10-
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
397n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-12 preincubated for 15 mins by stopped flow CO2 hydration ...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50082761
PNG
(CHEMBL3423260)
Show SMILES NS(=O)(=O)c1ccc(CCNCc2cc(Br)cc(Br)c2O)cc1
Show InChI InChI=1S/C15H16Br2N2O3S/c16-12-7-11(15(20)14(17)8-12)9-19-6-5-10-1-3-13(4-2-10)23(18,21)22/h1-4,7-8,19-20H,5-6,9H2,(H2,18,21,22)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
405n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-1 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50082740
PNG
(CHEMBL3423253)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C/c2cc(Br)ccc2O)cc1
Show InChI InChI=1S/C15H15BrN2O3S/c16-13-3-6-15(19)12(9-13)10-18-8-7-11-1-4-14(5-2-11)22(17,20)21/h1-6,9-10,19H,7-8H2,(H2,17,20,21)/b18-10-
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
413n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-2 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50082738
PNG
(CHEMBL3423249)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C/c2cc(Br)cc(Br)c2O)cc1
Show InChI InChI=1S/C15H14Br2N2O3S/c16-12-7-11(15(20)14(17)8-12)9-19-6-5-10-1-3-13(4-2-10)23(18,21)22/h1-4,7-9,20H,5-6H2,(H2,18,21,22)/b19-9-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
421n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-1 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50082753
PNG
(CHEMBL3423254)
Show SMILES Cc1ccc(\C=N/CCc2ccc(cc2)S(N)(=O)=O)cc1
Show InChI InChI=1S/C16H18N2O2S/c1-13-2-4-15(5-3-13)12-18-11-10-14-6-8-16(9-7-14)21(17,19)20/h2-9,12H,10-11H2,1H3,(H2,17,19,20)/b18-12-
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents

Article
PubMed
433n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-2 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50082727
PNG
(CHEMBL3423250)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C/c2ccccc2)cc1
Show InChI InChI=1S/C15H16N2O2S/c16-20(18,19)15-8-6-13(7-9-15)10-11-17-12-14-4-2-1-3-5-14/h1-9,12H,10-11H2,(H2,16,18,19)/b17-12-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
437n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-1 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50082669
PNG
(CHEMBL3423252)
Show SMILES COc1ccc(\C=N/CCc2ccc(cc2)S(N)(=O)=O)cc1
Show InChI InChI=1S/C16H18N2O3S/c1-21-15-6-2-14(3-7-15)12-18-11-10-13-4-8-16(9-5-13)22(17,19)20/h2-9,12H,10-11H2,1H3,(H2,17,19,20)/b18-12-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
442n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-1 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50082686
PNG
(CHEMBL3423251)
Show SMILES Cc1cccc(\C=N/CCc2ccc(cc2)S(N)(=O)=O)c1O
Show InChI InChI=1S/C16H18N2O3S/c1-12-3-2-4-14(16(12)19)11-18-10-9-13-5-7-15(8-6-13)22(17,20)21/h2-8,11,19H,9-10H2,1H3,(H2,17,20,21)/b18-11-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
448n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-1 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50082757
PNG
(CHEMBL3423258)
Show SMILES CN(C)c1ccc(\C=N/CCc2ccc(cc2)S(N)(=O)=O)cc1
Show InChI InChI=1S/C17H21N3O2S/c1-20(2)16-7-3-15(4-8-16)13-19-12-11-14-5-9-17(10-6-14)23(18,21)22/h3-10,13H,11-12H2,1-2H3,(H2,18,21,22)/b19-13-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
453n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-1 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50082756
PNG
(CHEMBL3423257)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C/c2cc(Cl)cc(Cl)c2O)cc1
Show InChI InChI=1S/C15H14Cl2N2O3S/c16-12-7-11(15(20)14(17)8-12)9-19-6-5-10-1-3-13(4-2-10)23(18,21)22/h1-4,7-9,20H,5-6H2,(H2,18,21,22)/b19-9-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
454n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-1 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50082739
PNG
(CHEMBL3421649)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C/c2ccccc2O)cc1
Show InChI InChI=1S/C15H16N2O3S/c16-21(19,20)14-7-5-12(6-8-14)9-10-17-11-13-3-1-2-4-15(13)18/h1-8,11,18H,9-10H2,(H2,16,19,20)/b17-11-
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
474n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-2 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50082669
PNG
(CHEMBL3423252)
Show SMILES COc1ccc(\C=N/CCc2ccc(cc2)S(N)(=O)=O)cc1
Show InChI InChI=1S/C16H18N2O3S/c1-21-15-6-2-14(3-7-15)12-18-11-10-13-4-8-16(9-5-13)22(17,19)20/h2-9,12H,10-11H2,1H3,(H2,17,19,20)/b18-12-
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
600n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-2 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50082686
PNG
(CHEMBL3423251)
Show SMILES Cc1cccc(\C=N/CCc2ccc(cc2)S(N)(=O)=O)c1O
Show InChI InChI=1S/C16H18N2O3S/c1-12-3-2-4-14(16(12)19)11-18-10-9-13-5-7-15(8-6-13)22(17,20)21/h2-8,11,19H,9-10H2,1H3,(H2,17,20,21)/b18-11-
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
619n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-2 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50082755
PNG
(CHEMBL3423256)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C/c2ccc(OCc3ccccc3)cc2)cc1
Show InChI InChI=1S/C22H22N2O3S/c23-28(25,26)22-12-8-18(9-13-22)14-15-24-16-19-6-10-21(11-7-19)27-17-20-4-2-1-3-5-20/h1-13,16H,14-15,17H2,(H2,23,25,26)/b24-16-
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
819n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-2 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50082738
PNG
(CHEMBL3423249)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C/c2cc(Br)cc(Br)c2O)cc1
Show InChI InChI=1S/C15H14Br2N2O3S/c16-12-7-11(15(20)14(17)8-12)9-19-6-5-10-1-3-13(4-2-10)23(18,21)22/h1-4,7-9,20H,5-6H2,(H2,18,21,22)/b19-9-
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
837n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-12 preincubated for 15 mins by stopped flow CO2 hydration ...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50082669
PNG
(CHEMBL3423252)
Show SMILES COc1ccc(\C=N/CCc2ccc(cc2)S(N)(=O)=O)cc1
Show InChI InChI=1S/C16H18N2O3S/c1-21-15-6-2-14(3-7-15)12-18-11-10-13-4-8-16(9-5-13)22(17,19)20/h2-9,12H,10-11H2,1H3,(H2,17,19,20)/b18-12-
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
1.05E+3n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-12 preincubated for 15 mins by stopped flow CO2 hydration ...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50082753
PNG
(CHEMBL3423254)
Show SMILES Cc1ccc(\C=N/CCc2ccc(cc2)S(N)(=O)=O)cc1
Show InChI InChI=1S/C16H18N2O2S/c1-13-2-4-15(5-3-13)12-18-11-10-14-6-8-16(9-7-14)21(17,19)20/h2-9,12H,10-11H2,1H3,(H2,17,19,20)/b18-12-
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents

Article
PubMed
1.08E+3n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-12 preincubated for 15 mins by stopped flow CO2 hydration ...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50082686
PNG
(CHEMBL3423251)
Show SMILES Cc1cccc(\C=N/CCc2ccc(cc2)S(N)(=O)=O)c1O
Show InChI InChI=1S/C16H18N2O3S/c1-12-3-2-4-14(16(12)19)11-18-10-9-13-5-7-15(8-6-13)22(17,20)21/h2-8,11,19H,9-10H2,1H3,(H2,17,20,21)/b18-11-
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
1.11E+3n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-12 preincubated for 15 mins by stopped flow CO2 hydration ...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50082727
PNG
(CHEMBL3423250)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C/c2ccccc2)cc1
Show InChI InChI=1S/C15H16N2O2S/c16-20(18,19)15-8-6-13(7-9-15)10-11-17-12-14-4-2-1-3-5-14/h1-9,12H,10-11H2,(H2,16,18,19)/b17-12-
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
1.43E+3n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-12 preincubated for 15 mins by stopped flow CO2 hydration ...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50082755
PNG
(CHEMBL3423256)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C/c2ccc(OCc3ccccc3)cc2)cc1
Show InChI InChI=1S/C22H22N2O3S/c23-28(25,26)22-12-8-18(9-13-22)14-15-24-16-19-6-10-21(11-7-19)27-17-20-4-2-1-3-5-20/h1-13,16H,14-15,17H2,(H2,23,25,26)/b24-16-
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
1.47E+3n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-12 preincubated for 15 mins by stopped flow CO2 hydration ...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50082755
PNG
(CHEMBL3423256)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C/c2ccc(OCc3ccccc3)cc2)cc1
Show InChI InChI=1S/C22H22N2O3S/c23-28(25,26)22-12-8-18(9-13-22)14-15-24-16-19-6-10-21(11-7-19)27-17-20-4-2-1-3-5-20/h1-13,16H,14-15,17H2,(H2,23,25,26)/b24-16-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
1.70E+3n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human cytosolic form of carbonic anhydrase-1 preincubated for 15 mins by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50082756
PNG
(CHEMBL3423257)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C/c2cc(Cl)cc(Cl)c2O)cc1
Show InChI InChI=1S/C15H14Cl2N2O3S/c16-12-7-11(15(20)14(17)8-12)9-19-6-5-10-1-3-13(4-2-10)23(18,21)22/h1-4,7-9,20H,5-6H2,(H2,18,21,22)/b19-9-
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
1.95E+3n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-12 preincubated for 15 mins by stopped flow CO2 hydration ...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50082754
PNG
(CHEMBL3423255)
Show SMILES NS(=O)(=O)c1ccc(CC\N=C/c2cc(Cl)ccc2O)cc1
Show InChI InChI=1S/C15H15ClN2O3S/c16-13-3-6-15(19)12(9-13)10-18-8-7-11-1-4-14(5-2-11)22(17,20)21/h1-6,9-10,19H,7-8H2,(H2,17,20,21)/b18-10-
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents

Article
PubMed
2.14E+3n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-12 preincubated for 15 mins by stopped flow CO2 hydration ...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50082757
PNG
(CHEMBL3423258)
Show SMILES CN(C)c1ccc(\C=N/CCc2ccc(cc2)S(N)(=O)=O)cc1
Show InChI InChI=1S/C17H21N3O2S/c1-20(2)16-7-3-15(4-8-16)13-19-12-11-14-5-9-17(10-6-14)23(18,21)22/h3-10,13H,11-12H2,1-2H3,(H2,18,21,22)/b19-13-
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
3.12E+3n/an/an/an/an/an/an/an/a



Harran University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human transmembrane, tumor-associated form of carbonic anhydrase-12 preincubated for 15 mins by stopped flow CO2 hydration ...


Bioorg Med Chem Lett 25: 2377-81 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.007
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%