BDBM26998 6-chloro-3-(dichloromethyl)-1,1-dioxo-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-sulfonamide::TRICHLORMETHIAZIDE::trichloromethiazide, 6
SMILES: NS(=O)(=O)c1cc2c(NC(NS2(=O)=O)C(Cl)Cl)cc1Cl
InChI Key: InChIKey=LMJSLTNSBFUCMU-UHFFFAOYSA-N
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 7 (Homo sapiens (Human)) | BDBM26998 (6-chloro-3-(dichloromethyl)-1,1-dioxo-3,4-dihydro-...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents | Article PubMed | 7.90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universita degli Studi di Firenze | Assay Description An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic... | Bioorg Med Chem 17: 1214-21 (2009) Article DOI: 10.1016/j.bmc.2008.12.023 BindingDB Entry DOI: 10.7270/Q2FN14HZ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Carbonic anhydrase 9 (Homo sapiens (Human)) | BDBM26998 (6-chloro-3-(dichloromethyl)-1,1-dioxo-3,4-dihydro-...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents | Article PubMed | 87 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universita degli Studi di Firenze | Assay Description An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic... | Bioorg Med Chem 17: 1214-21 (2009) Article DOI: 10.1016/j.bmc.2008.12.023 BindingDB Entry DOI: 10.7270/Q2FN14HZ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Carbonic anhydrase 2 (Homo sapiens (Human)) | BDBM26998 (6-chloro-3-(dichloromethyl)-1,1-dioxo-3,4-dihydro-...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents | DrugBank PDB Article PubMed | 91 | -9.44 | n/a | n/a | n/a | n/a | n/a | 7.5 | 20 |
Universita degli Studi di Firenze | Assay Description An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic... | Bioorg Med Chem 17: 1214-21 (2009) Article DOI: 10.1016/j.bmc.2008.12.023 BindingDB Entry DOI: 10.7270/Q2FN14HZ | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) | ||||||||||||
Carbonic Anhydrase VB (Homo sapiens (Human)) | BDBM26998 (6-chloro-3-(dichloromethyl)-1,1-dioxo-3,4-dihydro-...) | Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet | Purchase DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents | Article PubMed | 134 | -9.21 | n/a | n/a | n/a | n/a | n/a | 7.5 | 20 |
Universita degli Studi di Firenze | Assay Description An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic... | Bioorg Med Chem 17: 1214-21 (2009) Article DOI: 10.1016/j.bmc.2008.12.023 BindingDB Entry DOI: 10.7270/Q2FN14HZ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Carbonic anhydrase 12 (Homo sapiens (Human)) | BDBM26998 (6-chloro-3-(dichloromethyl)-1,1-dioxo-3,4-dihydro-...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents | Article PubMed | 312 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universita degli Studi di Firenze | Assay Description An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic... | Bioorg Med Chem 17: 1214-21 (2009) Article DOI: 10.1016/j.bmc.2008.12.023 BindingDB Entry DOI: 10.7270/Q2FN14HZ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Carbonic anhydrase 1 (Homo sapiens (Human)) | BDBM26998 (6-chloro-3-(dichloromethyl)-1,1-dioxo-3,4-dihydro-...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents | DrugBank Article PubMed | 345 | -8.66 | n/a | n/a | n/a | n/a | n/a | 7.5 | 20 |
Universita degli Studi di Firenze | Assay Description An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic... | Bioorg Med Chem 17: 1214-21 (2009) Article DOI: 10.1016/j.bmc.2008.12.023 BindingDB Entry DOI: 10.7270/Q2FN14HZ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Carbonic anhydrase 4 (Homo sapiens (Human)) | BDBM26998 (6-chloro-3-(dichloromethyl)-1,1-dioxo-3,4-dihydro-...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents | DrugBank Article PubMed | 449 | -8.51 | n/a | n/a | n/a | n/a | n/a | 7.5 | 20 |
Universita degli Studi di Firenze | Assay Description An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic... | Bioorg Med Chem 17: 1214-21 (2009) Article DOI: 10.1016/j.bmc.2008.12.023 BindingDB Entry DOI: 10.7270/Q2FN14HZ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Carbonic Anhydrase XIII (Mus musculus (mouse)) | BDBM26998 (6-chloro-3-(dichloromethyl)-1,1-dioxo-3,4-dihydro-...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents | Article PubMed | 645 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universita degli Studi di Firenze | Assay Description An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic... | Bioorg Med Chem 17: 1214-21 (2009) Article DOI: 10.1016/j.bmc.2008.12.023 BindingDB Entry DOI: 10.7270/Q2FN14HZ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Carbonic Anhydrase VA (Homo sapiens (Human)) | BDBM26998 (6-chloro-3-(dichloromethyl)-1,1-dioxo-3,4-dihydro-...) | Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | Purchase DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents | Article PubMed | 763 | -8.20 | n/a | n/a | n/a | n/a | n/a | 7.5 | 20 |
Universita degli Studi di Firenze | Assay Description An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic... | Bioorg Med Chem 17: 1214-21 (2009) Article DOI: 10.1016/j.bmc.2008.12.023 BindingDB Entry DOI: 10.7270/Q2FN14HZ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Carbonic anhydrase 6 (CA-VI) (Homo sapiens (Human)) | BDBM26998 (6-chloro-3-(dichloromethyl)-1,1-dioxo-3,4-dihydro-...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents | Article PubMed | 2.46E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universita degli Studi di Firenze | Assay Description An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic... | Bioorg Med Chem 17: 1214-21 (2009) Article DOI: 10.1016/j.bmc.2008.12.023 BindingDB Entry DOI: 10.7270/Q2FN14HZ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Carbonic Anhydrase XIV (Homo sapiens (Human)) | BDBM26998 (6-chloro-3-(dichloromethyl)-1,1-dioxo-3,4-dihydro-...) | PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet | Purchase DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents | Article PubMed | 3.45E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universita degli Studi di Firenze | Assay Description An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic... | Bioorg Med Chem 17: 1214-21 (2009) Article DOI: 10.1016/j.bmc.2008.12.023 BindingDB Entry DOI: 10.7270/Q2FN14HZ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Carbonic Anhydrase III (Homo sapiens (Human)) | BDBM26998 (6-chloro-3-(dichloromethyl)-1,1-dioxo-3,4-dihydro-...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents | Article PubMed | 5.60E+5 | -4.36 | n/a | n/a | n/a | n/a | n/a | 7.5 | 20 |
Universita degli Studi di Firenze | Assay Description An Applied Photophysics stopped-flow instrument has been used for assaying the CA-catalyzed CO2 hydration activity. Phenol red has been used as indic... | Bioorg Med Chem 17: 1214-21 (2009) Article DOI: 10.1016/j.bmc.2008.12.023 BindingDB Entry DOI: 10.7270/Q2FN14HZ | |||||||||||
More data for this Ligand-Target Pair |