Found 42 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 2
(Homo sapiens (Human)) | BDBM50049520
(CHEMBL3314185)Show SMILES COC(=O)C(CCCCNC(=O)OCc1ccccc1)NC(=O)c1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C22H27N3O7S/c1-31-21(27)19(25-20(26)17-10-12-18(13-11-17)33(23,29)30)9-5-6-14-24-22(28)32-15-16-7-3-2-4-8-16/h2-4,7-8,10-13,19H,5-6,9,14-15H2,1H3,(H,24,28)(H,25,26)(H2,23,29,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.40 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50049514
(CHEMBL3314183)Show SMILES CC(C)(C)OC(=O)NCCCC(=O)Nc1cccc(c1)S(N)(=O)=O Show InChI InChI=1S/C15H23N3O5S/c1-15(2,3)23-14(20)17-9-5-8-13(19)18-11-6-4-7-12(10-11)24(16,21)22/h4,6-7,10H,5,8-9H2,1-3H3,(H,17,20)(H,18,19)(H2,16,21,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
MMDB
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 5.90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50049518
(CHEMBL3314167)Show SMILES CC(C)(C)OC(=O)NCCCC(=O)NCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C16H25N3O5S/c1-16(2,3)24-15(21)18-10-4-5-14(20)19-11-12-6-8-13(9-7-12)25(17,22)23/h6-9H,4-5,10-11H2,1-3H3,(H,18,21)(H,19,20)(H2,17,22,23) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 9.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
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 |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50049518
(CHEMBL3314167)Show SMILES CC(C)(C)OC(=O)NCCCC(=O)NCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C16H25N3O5S/c1-16(2,3)24-15(21)18-10-4-5-14(20)19-11-12-6-8-13(9-7-12)25(17,22)23/h6-9H,4-5,10-11H2,1-3H3,(H,18,21)(H,19,20)(H2,17,22,23) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50049514
(CHEMBL3314183)Show SMILES CC(C)(C)OC(=O)NCCCC(=O)Nc1cccc(c1)S(N)(=O)=O Show InChI InChI=1S/C15H23N3O5S/c1-15(2,3)23-14(20)17-9-5-8-13(19)18-11-6-4-7-12(10-11)24(16,21)22/h4,6-7,10H,5,8-9H2,1-3H3,(H,17,20)(H,18,19)(H2,16,21,22) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
MMDB
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 22 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50049517
(CHEMBL3314184)Show SMILES CC(C)(C)OC(=O)NCCCC(=O)Nc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C15H23N3O5S/c1-15(2,3)23-14(20)17-10-4-5-13(19)18-11-6-8-12(9-7-11)24(16,21)22/h6-9H,4-5,10H2,1-3H3,(H,17,20)(H,18,19)(H2,16,21,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 29 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50049491
(CHEMBL3314182)Show SMILES CC(=O)NC(CCCCNC(N)=N)C(=O)NCCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C17H28N6O4S/c1-12(24)23-15(4-2-3-10-22-17(18)19)16(25)21-11-9-13-5-7-14(8-6-13)28(20,26)27/h5-8,15H,2-4,9-11H2,1H3,(H,21,25)(H,23,24)(H4,18,19,22)(H2,20,26,27) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 44 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50049464
(CHEMBL3314175)Show SMILES CC(=O)NC(CCCCNC(=O)OC(C)(C)C)C(=O)NCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C20H32N4O6S/c1-14(25)24-17(7-5-6-12-22-19(27)30-20(2,3)4)18(26)23-13-15-8-10-16(11-9-15)31(21,28)29/h8-11,17H,5-7,12-13H2,1-4H3,(H,22,27)(H,23,26)(H,24,25)(H2,21,28,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 71 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50049461
(CHEMBL3314172)Show SMILES CC(C)(C)OC(=O)N\C(NCCCC(=O)NCCc1ccc(cc1)S(N)(=O)=O)=N\C(=O)OC(C)(C)C Show InChI InChI=1S/C23H37N5O7S/c1-22(2,3)34-20(30)27-19(28-21(31)35-23(4,5)6)26-14-7-8-18(29)25-15-13-16-9-11-17(12-10-16)36(24,32)33/h9-12H,7-8,13-15H2,1-6H3,(H,25,29)(H2,24,32,33)(H2,26,27,28,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 71 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50049465
(CHEMBL3314176)Show SMILES CC(=O)NC(CCCCNC(=O)OC(C)(C)C)C(=O)NCCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C21H34N4O6S/c1-15(26)25-18(7-5-6-13-24-20(28)31-21(2,3)4)19(27)23-14-12-16-8-10-17(11-9-16)32(22,29)30/h8-11,18H,5-7,12-14H2,1-4H3,(H,23,27)(H,24,28)(H,25,26)(H2,22,29,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 76 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50049460
(CHEMBL3314171)Show SMILES CC(C)(C)OC(=O)N\C(NCCCC(=O)NCc1ccc(cc1)S(N)(=O)=O)=N\C(=O)OC(C)(C)C Show InChI InChI=1S/C22H35N5O7S/c1-21(2,3)33-19(29)26-18(27-20(30)34-22(4,5)6)24-13-7-8-17(28)25-14-15-9-11-16(12-10-15)35(23,31)32/h9-12H,7-8,13-14H2,1-6H3,(H,25,28)(H2,23,31,32)(H2,24,26,27,29,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 83 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50415860
(CHEMBL204338)Show InChI InChI=1S/C11H17N3O3S/c12-7-1-2-11(15)14-8-9-3-5-10(6-4-9)18(13,16)17/h3-6H,1-2,7-8,12H2,(H,14,15)(H2,13,16,17) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 84 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50049520
(CHEMBL3314185)Show SMILES COC(=O)C(CCCCNC(=O)OCc1ccccc1)NC(=O)c1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C22H27N3O7S/c1-31-21(27)19(25-20(26)17-10-12-18(13-11-17)33(23,29)30)9-5-6-14-24-22(28)32-15-16-7-3-2-4-8-16/h2-4,7-8,10-13,19H,5-6,9,14-15H2,1H3,(H,24,28)(H,25,26)(H2,23,29,30) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 89 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50049519
(CHEMBL3314168)Show SMILES CC(C)(C)OC(=O)NCCCC(=O)NCCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C17H27N3O5S/c1-17(2,3)25-16(22)20-11-4-5-15(21)19-12-10-13-6-8-14(9-7-13)26(18,23)24/h6-9H,4-5,10-12H2,1-3H3,(H,19,21)(H,20,22)(H2,18,23,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 92 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50049517
(CHEMBL3314184)Show SMILES CC(C)(C)OC(=O)NCCCC(=O)Nc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C15H23N3O5S/c1-15(2,3)23-14(20)17-10-4-5-13(19)18-11-6-8-12(9-7-11)24(16,21)22/h6-9H,4-5,10H2,1-3H3,(H,17,20)(H,18,19)(H2,16,21,22) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 151 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50049460
(CHEMBL3314171)Show SMILES CC(C)(C)OC(=O)N\C(NCCCC(=O)NCc1ccc(cc1)S(N)(=O)=O)=N\C(=O)OC(C)(C)C Show InChI InChI=1S/C22H35N5O7S/c1-21(2,3)33-19(29)26-18(27-20(30)34-22(4,5)6)24-13-7-8-17(28)25-14-15-9-11-16(12-10-15)35(23,31)32/h9-12H,7-8,13-14H2,1-6H3,(H,25,28)(H2,23,31,32)(H2,24,26,27,29,30) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 193 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50415861
(CHEMBL383517)Show InChI InChI=1S/C12H19N3O3S/c13-8-1-2-12(16)15-9-7-10-3-5-11(6-4-10)19(14,17)18/h3-6H,1-2,7-9,13H2,(H,15,16)(H2,14,17,18) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 197 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
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 |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50049519
(CHEMBL3314168)Show SMILES CC(C)(C)OC(=O)NCCCC(=O)NCCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C17H27N3O5S/c1-17(2,3)25-16(22)20-11-4-5-15(21)19-12-10-13-6-8-14(9-7-13)26(18,23)24/h6-9H,4-5,10-12H2,1-3H3,(H,19,21)(H,20,22)(H2,18,23,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 253 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50049461
(CHEMBL3314172)Show SMILES CC(C)(C)OC(=O)N\C(NCCCC(=O)NCCc1ccc(cc1)S(N)(=O)=O)=N\C(=O)OC(C)(C)C Show InChI InChI=1S/C23H37N5O7S/c1-22(2,3)34-20(30)27-19(28-21(31)35-23(4,5)6)26-14-7-8-18(29)25-15-13-16-9-11-17(12-10-16)36(24,32)33/h9-12H,7-8,13-15H2,1-6H3,(H,25,29)(H2,24,32,33)(H2,26,27,28,30,31) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 267 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50049491
(CHEMBL3314182)Show SMILES CC(=O)NC(CCCCNC(N)=N)C(=O)NCCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C17H28N6O4S/c1-12(24)23-15(4-2-3-10-22-17(18)19)16(25)21-11-9-13-5-7-14(8-6-13)28(20,26)27/h5-8,15H,2-4,9-11H2,1H3,(H,21,25)(H,23,24)(H4,18,19,22)(H2,20,26,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 289 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50049483
(CHEMBL3314179)Show SMILES CC(=O)NC(CCCCN\C(NC(=O)OC(C)(C)C)=N\C(=O)OC(C)(C)C)C(=O)NCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C26H42N6O8S/c1-17(33)30-20(21(34)29-16-18-11-13-19(14-12-18)41(27,37)38)10-8-9-15-28-22(31-23(35)39-25(2,3)4)32-24(36)40-26(5,6)7/h11-14,20H,8-10,15-16H2,1-7H3,(H,29,34)(H,30,33)(H2,27,37,38)(H2,28,31,32,35,36) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 384 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50049465
(CHEMBL3314176)Show SMILES CC(=O)NC(CCCCNC(=O)OC(C)(C)C)C(=O)NCCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C21H34N4O6S/c1-15(26)25-18(7-5-6-13-24-20(28)31-21(2,3)4)19(27)23-14-12-16-8-10-17(11-9-16)32(22,29)30/h8-11,18H,5-7,12-14H2,1-4H3,(H,23,27)(H,24,28)(H,25,26)(H2,22,29,30) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 430 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50049484
(CHEMBL3314180)Show SMILES CC(=O)NC(CCCCN\C(NC(=O)OC(C)(C)C)=N\C(=O)OC(C)(C)C)C(=O)NCCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C27H44N6O8S/c1-18(34)31-21(22(35)29-17-15-19-11-13-20(14-12-19)42(28,38)39)10-8-9-16-30-23(32-24(36)40-26(2,3)4)33-25(37)41-27(5,6)7/h11-14,21H,8-10,15-17H2,1-7H3,(H,29,35)(H,31,34)(H2,28,38,39)(H2,30,32,33,36,37) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 452 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50049462
(CHEMBL3314173)Show InChI InChI=1S/C12H19N5O3S/c13-12(14)16-7-1-2-11(18)17-8-9-3-5-10(6-4-9)21(15,19)20/h3-6H,1-2,7-8H2,(H,17,18)(H4,13,14,16)(H2,15,19,20) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 470 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50049482
(CHEMBL3314178)Show SMILES Cl.CC(=O)NC(CCCCN)C(=O)NCCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C16H26N4O4S/c1-12(21)20-15(4-2-3-10-17)16(22)19-11-9-13-5-7-14(8-6-13)25(18,23)24/h5-8,15H,2-4,9-11,17H2,1H3,(H,19,22)(H,20,21)(H2,18,23,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 473 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50049464
(CHEMBL3314175)Show SMILES CC(=O)NC(CCCCNC(=O)OC(C)(C)C)C(=O)NCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C20H32N4O6S/c1-14(25)24-17(7-5-6-12-22-19(27)30-20(2,3)4)18(26)23-13-15-8-10-16(11-9-15)31(21,28)29/h8-11,17H,5-7,12-13H2,1-4H3,(H,22,27)(H,23,26)(H,24,25)(H2,21,28,29) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 484 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50415861
(CHEMBL383517)Show InChI InChI=1S/C12H19N3O3S/c13-8-1-2-12(16)15-9-7-10-3-5-11(6-4-10)19(14,17)18/h3-6H,1-2,7-9,13H2,(H,15,16)(H2,14,17,18) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 517 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50049484
(CHEMBL3314180)Show SMILES CC(=O)NC(CCCCN\C(NC(=O)OC(C)(C)C)=N\C(=O)OC(C)(C)C)C(=O)NCCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C27H44N6O8S/c1-18(34)31-21(22(35)29-17-15-19-11-13-20(14-12-19)42(28,38)39)10-8-9-16-30-23(32-24(36)40-26(2,3)4)33-25(37)41-27(5,6)7/h11-14,21H,8-10,15-17H2,1-7H3,(H,29,35)(H,31,34)(H2,28,38,39)(H2,30,32,33,36,37) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 519 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50049466
(CHEMBL3314177)Show SMILES Cl.CC(=O)NC(CCCCN)C(=O)NCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C15H24N4O4S.ClH/c1-11(20)19-14(4-2-3-9-16)15(21)18-10-12-5-7-13(8-6-12)24(17,22)23;/h5-8,14H,2-4,9-10,16H2,1H3,(H,18,21)(H,19,20)(H2,17,22,23);1H | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 563 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50049482
(CHEMBL3314178)Show SMILES Cl.CC(=O)NC(CCCCN)C(=O)NCCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C16H26N4O4S/c1-12(21)20-15(4-2-3-10-17)16(22)19-11-9-13-5-7-14(8-6-13)25(18,23)24/h5-8,15H,2-4,9-11,17H2,1H3,(H,19,22)(H,20,21)(H2,18,23,24) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 626 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50049485
(CHEMBL3314181)Show SMILES CC(=O)NC(CCCCNC(N)=N)C(=O)NCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C16H26N6O4S/c1-11(23)22-14(4-2-3-9-20-16(17)18)15(24)21-10-12-5-7-13(8-6-12)27(19,25)26/h5-8,14H,2-4,9-10H2,1H3,(H,21,24)(H,22,23)(H4,17,18,20)(H2,19,25,26) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 824 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50049463
(CHEMBL3314174)Show InChI InChI=1S/C13H21N5O3S/c14-13(15)18-8-1-2-12(19)17-9-7-10-3-5-11(6-4-10)22(16,20)21/h3-6H,1-2,7-9H2,(H,17,19)(H4,14,15,18)(H2,16,20,21) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 847 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50049462
(CHEMBL3314173)Show InChI InChI=1S/C12H19N5O3S/c13-12(14)16-7-1-2-11(18)17-8-9-3-5-10(6-4-9)21(15,19)20/h3-6H,1-2,7-8H2,(H,17,18)(H4,13,14,16)(H2,15,19,20) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 972 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50049463
(CHEMBL3314174)Show InChI InChI=1S/C13H21N5O3S/c14-13(15)18-8-1-2-12(19)17-9-7-10-3-5-11(6-4-10)22(16,20)21/h3-6H,1-2,7-9H2,(H,17,19)(H4,14,15,18)(H2,16,20,21) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.12E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50415860
(CHEMBL204338)Show InChI InChI=1S/C11H17N3O3S/c12-7-1-2-11(15)14-8-9-3-5-10(6-4-9)18(13,16)17/h3-6H,1-2,7-8,12H2,(H,14,15)(H2,13,16,17) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.27E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50049483
(CHEMBL3314179)Show SMILES CC(=O)NC(CCCCN\C(NC(=O)OC(C)(C)C)=N\C(=O)OC(C)(C)C)C(=O)NCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C26H42N6O8S/c1-17(33)30-20(21(34)29-16-18-11-13-19(14-12-18)41(27,37)38)10-8-9-15-28-22(31-23(35)39-25(2,3)4)32-24(36)40-26(5,6)7/h11-14,20H,8-10,15-16H2,1-7H3,(H,29,34)(H,30,33)(H2,27,37,38)(H2,28,31,32,35,36) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.31E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50049466
(CHEMBL3314177)Show SMILES Cl.CC(=O)NC(CCCCN)C(=O)NCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C15H24N4O4S.ClH/c1-11(20)19-14(4-2-3-9-16)15(21)18-10-12-5-7-13(8-6-12)24(17,22)23;/h5-8,14H,2-4,9-10,16H2,1H3,(H,18,21)(H,19,20)(H2,17,22,23);1H | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.33E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50049485
(CHEMBL3314181)Show SMILES CC(=O)NC(CCCCNC(N)=N)C(=O)NCc1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C16H26N6O4S/c1-11(23)22-14(4-2-3-9-20-16(17)18)15(24)21-10-12-5-7-13(8-6-12)27(19,25)26/h5-8,14H,2-4,9-10H2,1H3,(H,21,24)(H,22,23)(H4,17,18,20)(H2,19,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.15E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50049504
(CHEMBL3313934)Show SMILES CC(=O)NC(CCCCNC(=O)OC(C)(C)C)C(=O)Nc1cccc(c1)S(N)(=O)=O Show InChI InChI=1S/C19H30N4O6S/c1-13(24)22-16(10-5-6-11-21-18(26)29-19(2,3)4)17(25)23-14-8-7-9-15(12-14)30(20,27)28/h7-9,12,16H,5-6,10-11H2,1-4H3,(H,21,26)(H,22,24)(H,23,25)(H2,20,27,28) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 5.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50049504
(CHEMBL3313934)Show SMILES CC(=O)NC(CCCCNC(=O)OC(C)(C)C)C(=O)Nc1cccc(c1)S(N)(=O)=O Show InChI InChI=1S/C19H30N4O6S/c1-13(24)22-16(10-5-6-11-21-18(26)29-19(2,3)4)17(25)23-14-8-7-9-15(12-14)30(20,27)28/h7-9,12,16H,5-6,10-11H2,1-4H3,(H,21,26)(H,22,24)(H,23,25)(H2,20,27,28) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 6.03E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 by stopped flow CO2 hydration assay |
ACS Med Chem Lett 5: 826-30 (2014)
Article DOI: 10.1021/ml500192a
BindingDB Entry DOI: 10.7270/Q27P912D |
More data for this
Ligand-Target Pair | |
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