Found 4 hits for monomerid = 50456992 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 anhydrases; II & IX
(Homo sapiens (Human)) | BDBM50456992
(CHEMBL4214360)Show SMILES NS(=O)(=O)c1cccc(c1)\N=C1/NC(=O)\C(S1)=C1\C(=O)Nc2ccc(Br)cc12 Show InChI InChI=1S/C17H11BrN4O4S2/c18-8-4-5-12-11(6-8)13(15(23)21-12)14-16(24)22-17(27-14)20-9-2-1-3-10(7-9)28(19,25)26/h1-7H,(H,21,23)(H2,19,25,26)(H,20,22,24)/b14-13- | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 16 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kafrelsheikh University
Curated by ChEMBL
| Assay Description Inhibition of human transmembrane carbonic anhydrase 9 by stopped-flow CO2 hydrase assay |
Eur J Med Chem 139: 250-262 (2017)
Article DOI: 10.1016/j.ejmech.2017.07.073 BindingDB Entry DOI: 10.7270/Q22F7R2C |
More data for this Ligand-Target Pair | |
Carbonic anhydrase
(Homo sapiens (Human)) | BDBM50456992
(CHEMBL4214360)Show SMILES NS(=O)(=O)c1cccc(c1)\N=C1/NC(=O)\C(S1)=C1\C(=O)Nc2ccc(Br)cc12 Show InChI InChI=1S/C17H11BrN4O4S2/c18-8-4-5-12-11(6-8)13(15(23)21-12)14-16(24)22-17(27-14)20-9-2-1-3-10(7-9)28(19,25)26/h1-7H,(H,21,23)(H2,19,25,26)(H,20,22,24)/b14-13- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 235 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kafrelsheikh University
Curated by ChEMBL
| Assay Description Inhibition of human transmembrane carbonic anhydrase 4 by stopped-flow CO2 hydrase assay |
Eur J Med Chem 139: 250-262 (2017)
Article DOI: 10.1016/j.ejmech.2017.07.073 BindingDB Entry DOI: 10.7270/Q22F7R2C |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50456992
(CHEMBL4214360)Show SMILES NS(=O)(=O)c1cccc(c1)\N=C1/NC(=O)\C(S1)=C1\C(=O)Nc2ccc(Br)cc12 Show InChI InChI=1S/C17H11BrN4O4S2/c18-8-4-5-12-11(6-8)13(15(23)21-12)14-16(24)22-17(27-14)20-9-2-1-3-10(7-9)28(19,25)26/h1-7H,(H,21,23)(H2,19,25,26)(H,20,22,24)/b14-13- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 416 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kafrelsheikh University
Curated by ChEMBL
| Assay Description Inhibition of human cytosolic carbonic anhydrase 2 by stopped-flow CO2 hydrase assay |
Eur J Med Chem 139: 250-262 (2017)
Article DOI: 10.1016/j.ejmech.2017.07.073 BindingDB Entry DOI: 10.7270/Q22F7R2C |
More data for this Ligand-Target Pair | |
Carbonic anhydrase
(Homo sapiens (Human)) | BDBM50456992
(CHEMBL4214360)Show SMILES NS(=O)(=O)c1cccc(c1)\N=C1/NC(=O)\C(S1)=C1\C(=O)Nc2ccc(Br)cc12 Show InChI InChI=1S/C17H11BrN4O4S2/c18-8-4-5-12-11(6-8)13(15(23)21-12)14-16(24)22-17(27-14)20-9-2-1-3-10(7-9)28(19,25)26/h1-7H,(H,21,23)(H2,19,25,26)(H,20,22,24)/b14-13- | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 719 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kafrelsheikh University
Curated by ChEMBL
| Assay Description Inhibition of human cytosolic carbonic anhydrase 1 by stopped-flow CO2 hydrase assay |
Eur J Med Chem 139: 250-262 (2017)
Article DOI: 10.1016/j.ejmech.2017.07.073 BindingDB Entry DOI: 10.7270/Q22F7R2C |
More data for this Ligand-Target Pair | |