Found 40 hits of Enzyme Inhibition Constant Data Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Carbonic anhydrase 12
(Homo sapiens (Human)) | BDBM50054653
(CHEMBL3323211)Show SMILES NS(=O)(=O)c1ccc(NC(=O)NNS(=O)(=O)c2ccc(Cl)c(c2)[N+]([O-])=O)cc1 Show InChI InChI=1S/C13H12ClN5O7S2/c14-11-6-5-10(7-12(11)19(21)22)28(25,26)18-17-13(20)16-8-1-3-9(4-2-8)27(15,23)24/h1-7,18H,(H2,15,23,24)(H2,16,17,20) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 0.590 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 12 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 12
(Homo sapiens (Human)) | BDBM50054648
(CHEMBL3323207)Show SMILES NS(=O)(=O)c1ccc(NC(=O)NNS(=O)(=O)c2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C13H13ClN4O5S2/c14-9-1-5-12(6-2-9)25(22,23)18-17-13(19)16-10-3-7-11(8-4-10)24(15,20)21/h1-8,18H,(H2,15,20,21)(H2,16,17,19) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 0.630 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 12 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 12
(Homo sapiens (Human)) | BDBM50054646
(CHEMBL3323209)Show SMILES Cc1ccc(cc1)S(=O)(=O)NNC(=O)Nc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C14H16N4O5S2/c1-10-2-6-13(7-3-10)25(22,23)18-17-14(19)16-11-4-8-12(9-5-11)24(15,20)21/h2-9,18H,1H3,(H2,15,20,21)(H2,16,17,19) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 0.650 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 12 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 12
(Homo sapiens (Human)) | BDBM50054652
(CHEMBL3323212)Show SMILES COc1ccc(cc1)S(=O)(=O)NNC(=O)Nc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C14H16N4O6S2/c1-24-11-4-8-13(9-5-11)26(22,23)18-17-14(19)16-10-2-6-12(7-3-10)25(15,20)21/h2-9,18H,1H3,(H2,15,20,21)(H2,16,17,19) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 0.660 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 12 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 12
(Homo sapiens (Human)) | BDBM50054650
(CHEMBL3323205)Show SMILES NS(=O)(=O)c1ccc(NC(=O)NNS(=O)(=O)c2ccccc2)cc1 Show InChI InChI=1S/C13H14N4O5S2/c14-23(19,20)11-8-6-10(7-9-11)15-13(18)16-17-24(21,22)12-4-2-1-3-5-12/h1-9,17H,(H2,14,19,20)(H2,15,16,18) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 0.680 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 12 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 12
(Homo sapiens (Human)) | BDBM50054651
(CHEMBL3323213)Show SMILES CC(=O)Nc1ccc(cc1)S(=O)(=O)NNC(=O)Nc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C15H17N5O6S2/c1-10(21)17-11-4-8-14(9-5-11)28(25,26)20-19-15(22)18-12-2-6-13(7-3-12)27(16,23)24/h2-9,20H,1H3,(H,17,21)(H2,16,23,24)(H2,18,19,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 0.710 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 12 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 12
(Homo sapiens (Human)) | BDBM50054649
(CHEMBL3323206)Show SMILES NS(=O)(=O)c1ccc(NC(=O)NNS(=O)(=O)c2ccc(F)cc2)cc1 Show InChI InChI=1S/C13H13FN4O5S2/c14-9-1-5-12(6-2-9)25(22,23)18-17-13(19)16-10-3-7-11(8-4-10)24(15,20)21/h1-8,18H,(H2,15,20,21)(H2,16,17,19) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 0.720 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 12 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 12
(Homo sapiens (Human)) | BDBM50054647
(CHEMBL3323208)Show SMILES NS(=O)(=O)c1ccc(NC(=O)NNS(=O)(=O)c2ccc(Br)cc2)cc1 Show InChI InChI=1S/C13H13BrN4O5S2/c14-9-1-5-12(6-2-9)25(22,23)18-17-13(19)16-10-3-7-11(8-4-10)24(15,20)21/h1-8,18H,(H2,15,20,21)(H2,16,17,19) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 0.790 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 12 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 12
(Homo sapiens (Human)) | BDBM50054658
(CHEMBL3323210)Show SMILES NS(=O)(=O)c1ccc(NC(=O)NNS(=O)(=O)c2ccc(cc2)[N+]([O-])=O)cc1 Show InChI InChI=1S/C13H13N5O7S2/c14-26(22,23)11-5-1-9(2-6-11)15-13(19)16-17-27(24,25)12-7-3-10(4-8-12)18(20)21/h1-8,17H,(H2,14,22,23)(H2,15,16,19) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 0.790 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 12 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50054648
(CHEMBL3323207)Show SMILES NS(=O)(=O)c1ccc(NC(=O)NNS(=O)(=O)c2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C13H13ClN4O5S2/c14-9-1-5-12(6-2-9)25(22,23)18-17-13(19)16-10-3-7-11(8-4-10)24(15,20)21/h1-8,18H,(H2,15,20,21)(H2,16,17,19) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 3.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50054651
(CHEMBL3323213)Show SMILES CC(=O)Nc1ccc(cc1)S(=O)(=O)NNC(=O)Nc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C15H17N5O6S2/c1-10(21)17-11-4-8-14(9-5-11)28(25,26)20-19-15(22)18-12-2-6-13(7-3-12)27(16,23)24/h2-9,20H,1H3,(H,17,21)(H2,16,23,24)(H2,18,19,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 3.60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50054652
(CHEMBL3323212)Show SMILES COc1ccc(cc1)S(=O)(=O)NNC(=O)Nc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C14H16N4O6S2/c1-24-11-4-8-13(9-5-11)26(22,23)18-17-14(19)16-10-2-6-12(7-3-10)25(15,20)21/h2-9,18H,1H3,(H2,15,20,21)(H2,16,17,19) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50054647
(CHEMBL3323208)Show SMILES NS(=O)(=O)c1ccc(NC(=O)NNS(=O)(=O)c2ccc(Br)cc2)cc1 Show InChI InChI=1S/C13H13BrN4O5S2/c14-9-1-5-12(6-2-9)25(22,23)18-17-13(19)16-10-3-7-11(8-4-10)24(15,20)21/h1-8,18H,(H2,15,20,21)(H2,16,17,19) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50054650
(CHEMBL3323205)Show SMILES NS(=O)(=O)c1ccc(NC(=O)NNS(=O)(=O)c2ccccc2)cc1 Show InChI InChI=1S/C13H14N4O5S2/c14-23(19,20)11-8-6-10(7-9-11)15-13(18)16-17-24(21,22)12-4-2-1-3-5-12/h1-9,17H,(H2,14,19,20)(H2,15,16,18) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 12
(Homo sapiens (Human)) | BDBM10880
(AZA | AZA2 | AZM acetazolamide | Acerazolamide, AA...)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
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| PDB
Article
PubMed
| 5.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 12 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50054658
(CHEMBL3323210)Show SMILES NS(=O)(=O)c1ccc(NC(=O)NNS(=O)(=O)c2ccc(cc2)[N+]([O-])=O)cc1 Show InChI InChI=1S/C13H13N5O7S2/c14-26(22,23)11-5-1-9(2-6-11)15-13(19)16-17-27(24,25)12-7-3-10(4-8-12)18(20)21/h1-8,17H,(H2,14,22,23)(H2,15,16,19) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50054646
(CHEMBL3323209)Show SMILES Cc1ccc(cc1)S(=O)(=O)NNC(=O)Nc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C14H16N4O5S2/c1-10-2-6-13(7-3-10)25(22,23)18-17-14(19)16-11-4-8-12(9-5-11)24(15,20)21/h2-9,18H,1H3,(H2,15,20,21)(H2,16,17,19) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 6.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM10880
(AZA | AZA2 | AZM acetazolamide | Acerazolamide, AA...)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
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| DrugBank
MMDB
PDB
Article
PubMed
| 12 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50054649
(CHEMBL3323206)Show SMILES NS(=O)(=O)c1ccc(NC(=O)NNS(=O)(=O)c2ccc(F)cc2)cc1 Show InChI InChI=1S/C13H13FN4O5S2/c14-9-1-5-12(6-2-9)25(22,23)18-17-13(19)16-10-3-7-11(8-4-10)24(15,20)21/h1-8,18H,(H2,15,20,21)(H2,16,17,19) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 14 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM50054658
(CHEMBL3323210)Show SMILES NS(=O)(=O)c1ccc(NC(=O)NNS(=O)(=O)c2ccc(cc2)[N+]([O-])=O)cc1 Show InChI InChI=1S/C13H13N5O7S2/c14-26(22,23)11-5-1-9(2-6-11)15-13(19)16-17-27(24,25)12-7-3-10(4-8-12)18(20)21/h1-8,17H,(H2,14,22,23)(H2,15,16,19) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 21 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 9 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM50054648
(CHEMBL3323207)Show SMILES NS(=O)(=O)c1ccc(NC(=O)NNS(=O)(=O)c2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C13H13ClN4O5S2/c14-9-1-5-12(6-2-9)25(22,23)18-17-13(19)16-10-3-7-11(8-4-10)24(15,20)21/h1-8,18H,(H2,15,20,21)(H2,16,17,19) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 23 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 9 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM50054646
(CHEMBL3323209)Show SMILES Cc1ccc(cc1)S(=O)(=O)NNC(=O)Nc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C14H16N4O5S2/c1-10-2-6-13(7-3-10)25(22,23)18-17-14(19)16-11-4-8-12(9-5-11)24(15,20)21/h2-9,18H,1H3,(H2,15,20,21)(H2,16,17,19) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 24 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 9 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM50054649
(CHEMBL3323206)Show SMILES NS(=O)(=O)c1ccc(NC(=O)NNS(=O)(=O)c2ccc(F)cc2)cc1 Show InChI InChI=1S/C13H13FN4O5S2/c14-9-1-5-12(6-2-9)25(22,23)18-17-13(19)16-10-3-7-11(8-4-10)24(15,20)21/h1-8,18H,(H2,15,20,21)(H2,16,17,19) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 25 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 9 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM10880
(AZA | AZA2 | AZM acetazolamide | Acerazolamide, AA...)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
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| Article
PubMed
| 25 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 9 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM50054647
(CHEMBL3323208)Show SMILES NS(=O)(=O)c1ccc(NC(=O)NNS(=O)(=O)c2ccc(Br)cc2)cc1 Show InChI InChI=1S/C13H13BrN4O5S2/c14-9-1-5-12(6-2-9)25(22,23)18-17-13(19)16-10-3-7-11(8-4-10)24(15,20)21/h1-8,18H,(H2,15,20,21)(H2,16,17,19) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 30 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 9 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM50054653
(CHEMBL3323211)Show SMILES NS(=O)(=O)c1ccc(NC(=O)NNS(=O)(=O)c2ccc(Cl)c(c2)[N+]([O-])=O)cc1 Show InChI InChI=1S/C13H12ClN5O7S2/c14-11-6-5-10(7-12(11)19(21)22)28(25,26)18-17-13(20)16-8-1-3-9(4-2-8)27(15,23)24/h1-7,18H,(H2,15,23,24)(H2,16,17,20) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 39 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 9 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50054648
(CHEMBL3323207)Show SMILES NS(=O)(=O)c1ccc(NC(=O)NNS(=O)(=O)c2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C13H13ClN4O5S2/c14-9-1-5-12(6-2-9)25(22,23)18-17-13(19)16-10-3-7-11(8-4-10)24(15,20)21/h1-8,18H,(H2,15,20,21)(H2,16,17,19) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50054650
(CHEMBL3323205)Show SMILES NS(=O)(=O)c1ccc(NC(=O)NNS(=O)(=O)c2ccccc2)cc1 Show InChI InChI=1S/C13H14N4O5S2/c14-23(19,20)11-8-6-10(7-9-11)15-13(18)16-17-24(21,22)12-4-2-1-3-5-12/h1-9,17H,(H2,14,19,20)(H2,15,16,18) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 41 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50054651
(CHEMBL3323213)Show SMILES CC(=O)Nc1ccc(cc1)S(=O)(=O)NNC(=O)Nc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C15H17N5O6S2/c1-10(21)17-11-4-8-14(9-5-11)28(25,26)20-19-15(22)18-12-2-6-13(7-3-12)27(16,23)24/h2-9,20H,1H3,(H,17,21)(H2,16,23,24)(H2,18,19,22) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 41 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50054652
(CHEMBL3323212)Show SMILES COc1ccc(cc1)S(=O)(=O)NNC(=O)Nc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C14H16N4O6S2/c1-24-11-4-8-13(9-5-11)26(22,23)18-17-14(19)16-10-2-6-12(7-3-10)25(15,20)21/h2-9,18H,1H3,(H2,15,20,21)(H2,16,17,19) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 47 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50054646
(CHEMBL3323209)Show SMILES Cc1ccc(cc1)S(=O)(=O)NNC(=O)Nc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C14H16N4O5S2/c1-10-2-6-13(7-3-10)25(22,23)18-17-14(19)16-11-4-8-12(9-5-11)24(15,20)21/h2-9,18H,1H3,(H2,15,20,21)(H2,16,17,19) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 48 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50054658
(CHEMBL3323210)Show SMILES NS(=O)(=O)c1ccc(NC(=O)NNS(=O)(=O)c2ccc(cc2)[N+]([O-])=O)cc1 Show InChI InChI=1S/C13H13N5O7S2/c14-26(22,23)11-5-1-9(2-6-11)15-13(19)16-17-27(24,25)12-7-3-10(4-8-12)18(20)21/h1-8,17H,(H2,14,22,23)(H2,15,16,19) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 49 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50054647
(CHEMBL3323208)Show SMILES NS(=O)(=O)c1ccc(NC(=O)NNS(=O)(=O)c2ccc(Br)cc2)cc1 Show InChI InChI=1S/C13H13BrN4O5S2/c14-9-1-5-12(6-2-9)25(22,23)18-17-13(19)16-10-3-7-11(8-4-10)24(15,20)21/h1-8,18H,(H2,15,20,21)(H2,16,17,19) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 49 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50054653
(CHEMBL3323211)Show SMILES NS(=O)(=O)c1ccc(NC(=O)NNS(=O)(=O)c2ccc(Cl)c(c2)[N+]([O-])=O)cc1 Show InChI InChI=1S/C13H12ClN5O7S2/c14-11-6-5-10(7-12(11)19(21)22)28(25,26)18-17-13(20)16-8-1-3-9(4-2-8)27(15,23)24/h1-7,18H,(H2,15,23,24)(H2,16,17,20) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 53 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50054653
(CHEMBL3323211)Show SMILES NS(=O)(=O)c1ccc(NC(=O)NNS(=O)(=O)c2ccc(Cl)c(c2)[N+]([O-])=O)cc1 Show InChI InChI=1S/C13H12ClN5O7S2/c14-11-6-5-10(7-12(11)19(21)22)28(25,26)18-17-13(20)16-8-1-3-9(4-2-8)27(15,23)24/h1-7,18H,(H2,15,23,24)(H2,16,17,20) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 72 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM50054650
(CHEMBL3323205)Show SMILES NS(=O)(=O)c1ccc(NC(=O)NNS(=O)(=O)c2ccccc2)cc1 Show InChI InChI=1S/C13H14N4O5S2/c14-23(19,20)11-8-6-10(7-9-11)15-13(18)16-17-24(21,22)12-4-2-1-3-5-12/h1-9,17H,(H2,14,19,20)(H2,15,16,18) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 74 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 9 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM50054652
(CHEMBL3323212)Show SMILES COc1ccc(cc1)S(=O)(=O)NNC(=O)Nc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C14H16N4O6S2/c1-24-11-4-8-13(9-5-11)26(22,23)18-17-14(19)16-10-2-6-12(7-3-10)25(15,20)21/h2-9,18H,1H3,(H2,15,20,21)(H2,16,17,19) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 9 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM50054651
(CHEMBL3323213)Show SMILES CC(=O)Nc1ccc(cc1)S(=O)(=O)NNC(=O)Nc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C15H17N5O6S2/c1-10(21)17-11-4-8-14(9-5-11)28(25,26)20-19-15(22)18-12-2-6-13(7-3-12)27(16,23)24/h2-9,20H,1H3,(H,17,21)(H2,16,23,24)(H2,18,19,22) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 81 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 9 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50054649
(CHEMBL3323206)Show SMILES NS(=O)(=O)c1ccc(NC(=O)NNS(=O)(=O)c2ccc(F)cc2)cc1 Show InChI InChI=1S/C13H13FN4O5S2/c14-9-1-5-12(6-2-9)25(22,23)18-17-13(19)16-10-3-7-11(8-4-10)24(15,20)21/h1-8,18H,(H2,15,20,21)(H2,16,17,19) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 82 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM10880
(AZA | AZA2 | AZM acetazolamide | Acerazolamide, AA...)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
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| DrugBank
PDB
Article
PubMed
| 250 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Bharati Vidyapeeth's College of Pharmacy
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 preincubated for 15 mins by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 793-6 (2014)
Article DOI: 10.1021/ml500140t
BindingDB Entry DOI: 10.7270/Q2RR20WF |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Search and Browse
