Found 18 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)) | BDBM10884
((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
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| DrugBank
PDB
Article
PubMed
| 9 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NicOx Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 by CO2 hydrase stopped flow assay |
Bioorg Med Chem Lett 19: 6565-70 (2009)
Article DOI: 10.1016/j.bmcl.2009.10.036
BindingDB Entry DOI: 10.7270/Q2X92C80 |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50303032
(CHEMBL584939 | Ethyl-((4S,6S)-6-methyl-7,7-dioxo-2...)Show SMILES CCN([C@H]1C[C@H](C)S(=O)(=O)c2sc(cc12)S(N)(=O)=O)C(=O)OCCCO[N+]([O-])=O |r| Show InChI InChI=1S/C14H21N3O9S3/c1-3-16(14(18)25-5-4-6-26-17(19)20)11-7-9(2)28(21,22)13-10(11)8-12(27-13)29(15,23)24/h8-9,11H,3-7H2,1-2H3,(H2,15,23,24)/t9-,11-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 13 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NicOx Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 by CO2 hydrase stopped flow assay |
Bioorg Med Chem Lett 19: 6565-70 (2009)
Article DOI: 10.1016/j.bmcl.2009.10.036
BindingDB Entry DOI: 10.7270/Q2X92C80 |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50303030
(6-Nitrooxy-hexanoic acid ethyl-((4S,6S)-6-methyl-7...)Show SMILES CCN([C@H]1C[C@H](C)S(=O)(=O)c2sc(cc12)S(N)(=O)=O)C(=O)CCCCCO[N+]([O-])=O |r| Show InChI InChI=1S/C16H25N3O8S3/c1-3-18(14(20)7-5-4-6-8-27-19(21)22)13-9-11(2)29(23,24)16-12(13)10-15(28-16)30(17,25)26/h10-11,13H,3-9H2,1-2H3,(H2,17,25,26)/t11-,13-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 14 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NicOx Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 by CO2 hydrase stopped flow assay |
Bioorg Med Chem Lett 19: 6565-70 (2009)
Article DOI: 10.1016/j.bmcl.2009.10.036
BindingDB Entry DOI: 10.7270/Q2X92C80 |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 4
(Homo sapiens (Human)) | BDBM10884
((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
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| DrugBank
MMDB
PDB
Article
PubMed
| 43 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NicOx Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 4 by CO2 hydrase stopped flow assay |
Bioorg Med Chem Lett 19: 6565-70 (2009)
Article DOI: 10.1016/j.bmcl.2009.10.036
BindingDB Entry DOI: 10.7270/Q2X92C80 |
More data for this
Ligand-Target Pair |
3D Structure (crystal) |
Carbonic anhydrase 4
(Homo sapiens (Human)) | BDBM50303031
(CHEMBL570894 | N-Ethyl-N-((4S,6S)-6-methyl-7,7-dio...)Show SMILES CCN([C@H]1C[C@H](C)S(=O)(=O)c2sc(cc12)S(N)(=O)=O)C(=O)c1ccc(CO[N+]([O-])=O)cc1 |r| Show InChI InChI=1S/C18H21N3O8S3/c1-3-20(17(22)13-6-4-12(5-7-13)10-29-21(23)24)15-8-11(2)31(25,26)18-14(15)9-16(30-18)32(19,27)28/h4-7,9,11,15H,3,8,10H2,1-2H3,(H2,19,27,28)/t11-,15-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 46 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NicOx Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 4 by CO2 hydrase stopped flow assay |
Bioorg Med Chem Lett 19: 6565-70 (2009)
Article DOI: 10.1016/j.bmcl.2009.10.036
BindingDB Entry DOI: 10.7270/Q2X92C80 |
More data for this
Ligand-Target Pair |
3D Structure (docked) |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50303034
(CHEMBL571337 | Ethyl-((4S,6S)-6-methyl-7,7-dioxo-2...)Show SMILES CCN([C@H]1C[C@H](C)S(=O)(=O)c2sc(cc12)S(N)(=O)=O)C(=O)OCC(CO[N+]([O-])=O)O[N+]([O-])=O |r| Show InChI InChI=1S/C14H20N4O12S3/c1-3-16(14(19)28-6-9(30-18(22)23)7-29-17(20)21)11-4-8(2)32(24,25)13-10(11)5-12(31-13)33(15,26)27/h5,8-9,11H,3-4,6-7H2,1-2H3,(H2,15,26,27)/t8-,9?,11-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 63 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NicOx Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 by CO2 hydrase stopped flow assay |
Bioorg Med Chem Lett 19: 6565-70 (2009)
Article DOI: 10.1016/j.bmcl.2009.10.036
BindingDB Entry DOI: 10.7270/Q2X92C80 |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50303031
(CHEMBL570894 | N-Ethyl-N-((4S,6S)-6-methyl-7,7-dio...)Show SMILES CCN([C@H]1C[C@H](C)S(=O)(=O)c2sc(cc12)S(N)(=O)=O)C(=O)c1ccc(CO[N+]([O-])=O)cc1 |r| Show InChI InChI=1S/C18H21N3O8S3/c1-3-20(17(22)13-6-4-12(5-7-13)10-29-21(23)24)15-8-11(2)31(25,26)18-14(15)9-16(30-18)32(19,27)28/h4-7,9,11,15H,3,8,10H2,1-2H3,(H2,19,27,28)/t11-,15-/m0/s1 | 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 |
NicOx Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 by CO2 hydrase stopped flow assay |
Bioorg Med Chem Lett 19: 6565-70 (2009)
Article DOI: 10.1016/j.bmcl.2009.10.036
BindingDB Entry DOI: 10.7270/Q2X92C80 |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50303033
(CHEMBL585756 | Ethyl-((4S,6S)-6-methyl-7,7-dioxo-2...)Show SMILES CCN([C@H]1C[C@H](C)S(=O)(=O)c2sc(cc12)S(N)(=O)=O)C(=O)OCCCCO[N+]([O-])=O |r| Show InChI InChI=1S/C15H23N3O9S3/c1-3-17(15(19)26-6-4-5-7-27-18(20)21)12-8-10(2)29(22,23)14-11(12)9-13(28-14)30(16,24)25/h9-10,12H,3-8H2,1-2H3,(H2,16,24,25)/t10-,12-/m0/s1 | 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 |
NicOx Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 by CO2 hydrase stopped flow assay |
Bioorg Med Chem Lett 19: 6565-70 (2009)
Article DOI: 10.1016/j.bmcl.2009.10.036
BindingDB Entry DOI: 10.7270/Q2X92C80 |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 4
(Homo sapiens (Human)) | BDBM50303032
(CHEMBL584939 | Ethyl-((4S,6S)-6-methyl-7,7-dioxo-2...)Show SMILES CCN([C@H]1C[C@H](C)S(=O)(=O)c2sc(cc12)S(N)(=O)=O)C(=O)OCCCO[N+]([O-])=O |r| Show InChI InChI=1S/C14H21N3O9S3/c1-3-16(14(18)25-5-4-6-26-17(19)20)11-7-9(2)28(21,22)13-10(11)8-12(27-13)29(15,23)24/h8-9,11H,3-7H2,1-2H3,(H2,15,23,24)/t9-,11-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 181 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NicOx Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 4 by CO2 hydrase stopped flow assay |
Bioorg Med Chem Lett 19: 6565-70 (2009)
Article DOI: 10.1016/j.bmcl.2009.10.036
BindingDB Entry DOI: 10.7270/Q2X92C80 |
More data for this
Ligand-Target Pair |
3D Structure (docked) |
Carbonic anhydrase 4
(Homo sapiens (Human)) | BDBM50303033
(CHEMBL585756 | Ethyl-((4S,6S)-6-methyl-7,7-dioxo-2...)Show SMILES CCN([C@H]1C[C@H](C)S(=O)(=O)c2sc(cc12)S(N)(=O)=O)C(=O)OCCCCO[N+]([O-])=O |r| Show InChI InChI=1S/C15H23N3O9S3/c1-3-17(15(19)26-6-4-5-7-27-18(20)21)12-8-10(2)29(22,23)14-11(12)9-13(28-14)30(16,24)25/h9-10,12H,3-8H2,1-2H3,(H2,16,24,25)/t10-,12-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 339 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NicOx Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 4 by CO2 hydrase stopped flow assay |
Bioorg Med Chem Lett 19: 6565-70 (2009)
Article DOI: 10.1016/j.bmcl.2009.10.036
BindingDB Entry DOI: 10.7270/Q2X92C80 |
More data for this
Ligand-Target Pair |
3D Structure (docked) |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50303032
(CHEMBL584939 | Ethyl-((4S,6S)-6-methyl-7,7-dioxo-2...)Show SMILES CCN([C@H]1C[C@H](C)S(=O)(=O)c2sc(cc12)S(N)(=O)=O)C(=O)OCCCO[N+]([O-])=O |r| Show InChI InChI=1S/C14H21N3O9S3/c1-3-16(14(18)25-5-4-6-26-17(19)20)11-7-9(2)28(21,22)13-10(11)8-12(27-13)29(15,23)24/h8-9,11H,3-7H2,1-2H3,(H2,15,23,24)/t9-,11-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 410 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NicOx Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 by CO2 hydrase stopped flow assay |
Bioorg Med Chem Lett 19: 6565-70 (2009)
Article DOI: 10.1016/j.bmcl.2009.10.036
BindingDB Entry DOI: 10.7270/Q2X92C80 |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50303031
(CHEMBL570894 | N-Ethyl-N-((4S,6S)-6-methyl-7,7-dio...)Show SMILES CCN([C@H]1C[C@H](C)S(=O)(=O)c2sc(cc12)S(N)(=O)=O)C(=O)c1ccc(CO[N+]([O-])=O)cc1 |r| Show InChI InChI=1S/C18H21N3O8S3/c1-3-20(17(22)13-6-4-12(5-7-13)10-29-21(23)24)15-8-11(2)31(25,26)18-14(15)9-16(30-18)32(19,27)28/h4-7,9,11,15H,3,8,10H2,1-2H3,(H2,19,27,28)/t11-,15-/m0/s1 | PDB
MMDB
NCI pathway
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 |
NicOx Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 by CO2 hydrase stopped flow assay |
Bioorg Med Chem Lett 19: 6565-70 (2009)
Article DOI: 10.1016/j.bmcl.2009.10.036
BindingDB Entry DOI: 10.7270/Q2X92C80 |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50303033
(CHEMBL585756 | Ethyl-((4S,6S)-6-methyl-7,7-dioxo-2...)Show SMILES CCN([C@H]1C[C@H](C)S(=O)(=O)c2sc(cc12)S(N)(=O)=O)C(=O)OCCCCO[N+]([O-])=O |r| Show InChI InChI=1S/C15H23N3O9S3/c1-3-17(15(19)26-6-4-5-7-27-18(20)21)12-8-10(2)29(22,23)14-11(12)9-13(28-14)30(16,24)25/h9-10,12H,3-8H2,1-2H3,(H2,16,24,25)/t10-,12-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 705 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NicOx Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 by CO2 hydrase stopped flow assay |
Bioorg Med Chem Lett 19: 6565-70 (2009)
Article DOI: 10.1016/j.bmcl.2009.10.036
BindingDB Entry DOI: 10.7270/Q2X92C80 |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50303034
(CHEMBL571337 | Ethyl-((4S,6S)-6-methyl-7,7-dioxo-2...)Show SMILES CCN([C@H]1C[C@H](C)S(=O)(=O)c2sc(cc12)S(N)(=O)=O)C(=O)OCC(CO[N+]([O-])=O)O[N+]([O-])=O |r| Show InChI InChI=1S/C14H20N4O12S3/c1-3-16(14(19)28-6-9(30-18(22)23)7-29-17(20)21)11-4-8(2)32(24,25)13-10(11)5-12(31-13)33(15,26)27/h5,8-9,11H,3-4,6-7H2,1-2H3,(H2,15,26,27)/t8-,9?,11-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.52E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NicOx Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 by CO2 hydrase stopped flow assay |
Bioorg Med Chem Lett 19: 6565-70 (2009)
Article DOI: 10.1016/j.bmcl.2009.10.036
BindingDB Entry DOI: 10.7270/Q2X92C80 |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50303030
(6-Nitrooxy-hexanoic acid ethyl-((4S,6S)-6-methyl-7...)Show SMILES CCN([C@H]1C[C@H](C)S(=O)(=O)c2sc(cc12)S(N)(=O)=O)C(=O)CCCCCO[N+]([O-])=O |r| Show InChI InChI=1S/C16H25N3O8S3/c1-3-18(14(20)7-5-4-6-8-27-19(21)22)13-9-11(2)29(23,24)16-12(13)10-15(28-16)30(17,25)26/h10-11,13H,3-9H2,1-2H3,(H2,17,25,26)/t11-,13-/m0/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.95E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NicOx Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 by CO2 hydrase stopped flow assay |
Bioorg Med Chem Lett 19: 6565-70 (2009)
Article DOI: 10.1016/j.bmcl.2009.10.036
BindingDB Entry DOI: 10.7270/Q2X92C80 |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 4
(Homo sapiens (Human)) | BDBM50303034
(CHEMBL571337 | Ethyl-((4S,6S)-6-methyl-7,7-dioxo-2...)Show SMILES CCN([C@H]1C[C@H](C)S(=O)(=O)c2sc(cc12)S(N)(=O)=O)C(=O)OCC(CO[N+]([O-])=O)O[N+]([O-])=O |r| Show InChI InChI=1S/C14H20N4O12S3/c1-3-16(14(19)28-6-9(30-18(22)23)7-29-17(20)21)11-4-8(2)32(24,25)13-10(11)5-12(31-13)33(15,26)27/h5,8-9,11H,3-4,6-7H2,1-2H3,(H2,15,26,27)/t8-,9?,11-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.91E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NicOx Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 4 by CO2 hydrase stopped flow assay |
Bioorg Med Chem Lett 19: 6565-70 (2009)
Article DOI: 10.1016/j.bmcl.2009.10.036
BindingDB Entry DOI: 10.7270/Q2X92C80 |
More data for this
Ligand-Target Pair |
3D Structure (docked) |
Carbonic anhydrase 4
(Homo sapiens (Human)) | BDBM50303030
(6-Nitrooxy-hexanoic acid ethyl-((4S,6S)-6-methyl-7...)Show SMILES CCN([C@H]1C[C@H](C)S(=O)(=O)c2sc(cc12)S(N)(=O)=O)C(=O)CCCCCO[N+]([O-])=O |r| Show InChI InChI=1S/C16H25N3O8S3/c1-3-18(14(20)7-5-4-6-8-27-19(21)22)13-9-11(2)29(23,24)16-12(13)10-15(28-16)30(17,25)26/h10-11,13H,3-9H2,1-2H3,(H2,17,25,26)/t11-,13-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.36E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NicOx Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 4 by CO2 hydrase stopped flow assay |
Bioorg Med Chem Lett 19: 6565-70 (2009)
Article DOI: 10.1016/j.bmcl.2009.10.036
BindingDB Entry DOI: 10.7270/Q2X92C80 |
More data for this
Ligand-Target Pair |
3D Structure (docked) |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM10884
((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
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
DrugBank
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| DrugBank
Article
PubMed
| 5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NicOx Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 by CO2 hydrase stopped flow assay |
Bioorg Med Chem Lett 19: 6565-70 (2009)
Article DOI: 10.1016/j.bmcl.2009.10.036
BindingDB Entry DOI: 10.7270/Q2X92C80 |
More data for this
Ligand-Target Pair | |
Search and Browse
