Found 6 hits for monomerid = 50259367 Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50259367
(CHEMBL513122 | Ethyl-1-(4-aminophenyl)-5-phenyl-3-...)Show SMILES CCOC(=O)c1c(nn(c1-c1ccccc1)-c1ccc(N)cc1)C(=O)Nc1nnc(s1)S(N)(=O)=O Show InChI InChI=1S/C21H19N7O5S2/c1-2-33-19(30)15-16(18(29)24-20-25-26-21(34-20)35(23,31)32)27-28(14-10-8-13(22)9-11-14)17(15)12-6-4-3-5-7-12/h3-11H,2,22H2,1H3,(H2,23,31,32)(H,24,25,29) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 1.24E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human carbonic anhydrase 2 by Lineweaver-Burk plot |
Bioorg Med Chem 17: 3295-301 (2009)
Article DOI: 10.1016/j.bmc.2009.03.048 BindingDB Entry DOI: 10.7270/Q2DZ087F |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50259367
(CHEMBL513122 | Ethyl-1-(4-aminophenyl)-5-phenyl-3-...)Show SMILES CCOC(=O)c1c(nn(c1-c1ccccc1)-c1ccc(N)cc1)C(=O)Nc1nnc(s1)S(N)(=O)=O Show InChI InChI=1S/C21H19N7O5S2/c1-2-33-19(30)15-16(18(29)24-20-25-26-21(34-20)35(23,31)32)27-28(14-10-8-13(22)9-11-14)17(15)12-6-4-3-5-7-12/h3-11H,2,22H2,1H3,(H2,23,31,32)(H,24,25,29) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 2.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of human carbonic anhydrase 1 by Lineweaver-Burk plot |
Bioorg Med Chem 17: 3295-301 (2009)
Article DOI: 10.1016/j.bmc.2009.03.048 BindingDB Entry DOI: 10.7270/Q2DZ087F |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50259367
(CHEMBL513122 | Ethyl-1-(4-aminophenyl)-5-phenyl-3-...)Show SMILES CCOC(=O)c1c(nn(c1-c1ccccc1)-c1ccc(N)cc1)C(=O)Nc1nnc(s1)S(N)(=O)=O Show InChI InChI=1S/C21H19N7O5S2/c1-2-33-19(30)15-16(18(29)24-20-25-26-21(34-20)35(23,31)32)27-28(14-10-8-13(22)9-11-14)17(15)12-6-4-3-5-7-12/h3-11H,2,22H2,1H3,(H2,23,31,32)(H,24,25,29) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 80 | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of CO2-hydratase activity of human carbonic anhydrase 2 by CO2 hydration method |
Bioorg Med Chem 17: 3295-301 (2009)
Article DOI: 10.1016/j.bmc.2009.03.048 BindingDB Entry DOI: 10.7270/Q2DZ087F |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50259367
(CHEMBL513122 | Ethyl-1-(4-aminophenyl)-5-phenyl-3-...)Show SMILES CCOC(=O)c1c(nn(c1-c1ccccc1)-c1ccc(N)cc1)C(=O)Nc1nnc(s1)S(N)(=O)=O Show InChI InChI=1S/C21H19N7O5S2/c1-2-33-19(30)15-16(18(29)24-20-25-26-21(34-20)35(23,31)32)27-28(14-10-8-13(22)9-11-14)17(15)12-6-4-3-5-7-12/h3-11H,2,22H2,1H3,(H2,23,31,32)(H,24,25,29) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 6.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of esterase activity of human carbonic anhydrase 1 by CO2 hydration method |
Bioorg Med Chem 17: 3295-301 (2009)
Article DOI: 10.1016/j.bmc.2009.03.048 BindingDB Entry DOI: 10.7270/Q2DZ087F |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50259367
(CHEMBL513122 | Ethyl-1-(4-aminophenyl)-5-phenyl-3-...)Show SMILES CCOC(=O)c1c(nn(c1-c1ccccc1)-c1ccc(N)cc1)C(=O)Nc1nnc(s1)S(N)(=O)=O Show InChI InChI=1S/C21H19N7O5S2/c1-2-33-19(30)15-16(18(29)24-20-25-26-21(34-20)35(23,31)32)27-28(14-10-8-13(22)9-11-14)17(15)12-6-4-3-5-7-12/h3-11H,2,22H2,1H3,(H2,23,31,32)(H,24,25,29) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 4.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of CO2-hydratase activity of human carbonic anhydrase 1 by CO2 hydration method |
Bioorg Med Chem 17: 3295-301 (2009)
Article DOI: 10.1016/j.bmc.2009.03.048 BindingDB Entry DOI: 10.7270/Q2DZ087F |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50259367
(CHEMBL513122 | Ethyl-1-(4-aminophenyl)-5-phenyl-3-...)Show SMILES CCOC(=O)c1c(nn(c1-c1ccccc1)-c1ccc(N)cc1)C(=O)Nc1nnc(s1)S(N)(=O)=O Show InChI InChI=1S/C21H19N7O5S2/c1-2-33-19(30)15-16(18(29)24-20-25-26-21(34-20)35(23,31)32)27-28(14-10-8-13(22)9-11-14)17(15)12-6-4-3-5-7-12/h3-11H,2,22H2,1H3,(H2,23,31,32)(H,24,25,29) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/a |
Dumlupinar University
Curated by ChEMBL
| Assay Description Inhibition of esterase activity of human carbonic anhydrase 2 by CO2 hydration method |
Bioorg Med Chem 17: 3295-301 (2009)
Article DOI: 10.1016/j.bmc.2009.03.048 BindingDB Entry DOI: 10.7270/Q2DZ087F |
More data for this Ligand-Target Pair | |