Identical Ligands in BindingDB

Found 18 hits 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   (259/259 = 100%)† (Homo sapiens (Human))	BDBM26979 (CHEMBL69710 | Cl- | POTASSIUM CHLORIDE | SODIUM CH...) Show SMILES [Cl-] Show InChI InChI=1S/ClH/h1H/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem	PDB Article PubMed	2.00E+8	-3.92	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 Lett 19: 1155-8 (2009) Article DOI: 10.1016/j.bmcl.2008.12.082 BindingDB Entry DOI: 10.7270/Q2KD1W79
					More data for this Ligand-Target Pair				3D Structure (crystal)
Carbonic anhydrase 2   (259/259 = 100%)† (Homo sapiens (Human))	BDBM26979 (CHEMBL69710 | Cl- | POTASSIUM CHLORIDE | SODIUM CH...) Show SMILES [Cl-] Show InChI InChI=1S/ClH/h1H/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem	PDB Article PubMed	2.00E+8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Istituto di Biochimica delle Proteine (IBP) Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase 2 preincubated for 15 mins by CO2 hydration stopped-flow assay				Bioorg Med Chem 21: 1465-9 (2013) Article DOI: 10.1016/j.bmc.2012.09.047 BindingDB Entry DOI: 10.7270/Q20R9QQQ
					More data for this Ligand-Target Pair				3D Structure (crystal)
Carbonic anhydrase 2   (259/259 = 100%)† (Homo sapiens (Human))	BDBM26979 (CHEMBL69710 | Cl- | POTASSIUM CHLORIDE | SODIUM CH...) Show SMILES [Cl-] Show InChI InChI=1S/ClH/h1H/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem	PDB Article PubMed	2.00E+8	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 preincubated for 15 mins by stopped flow CO2 hydration assay				Bioorg Med Chem Lett 23: 1636-8 (2013) Article DOI: 10.1016/j.bmcl.2013.01.084 BindingDB Entry DOI: 10.7270/Q2VD70TX
					More data for this Ligand-Target Pair				3D Structure (crystal)
Carbonic anhydrase 2   (259/259 = 100%)† (Homo sapiens (Human))	BDBM26979 (CHEMBL69710 | Cl- | POTASSIUM CHLORIDE | SODIUM CH...) Show SMILES [Cl-] Show InChI InChI=1S/ClH/h1H/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem	PDB Article PubMed	2.00E+8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kochi Medical School Curated by ChEMBL					Assay Description Inhibition of human recombinant wild type CA2 by stopped-flow CO2 hydration method				Bioorg Med Chem Lett 23: 256-60 (2012) Article DOI: 10.1016/j.bmcl.2012.10.103 BindingDB Entry DOI: 10.7270/Q2ZC846G
					More data for this Ligand-Target Pair				3D Structure (crystal)
Carbonic anhydrase 2   (259/259 = 100%)† (Homo sapiens (Human))	BDBM26979 (CHEMBL69710 | Cl- | POTASSIUM CHLORIDE | SODIUM CH...) Show SMILES [Cl-] Show InChI InChI=1S/ClH/h1H/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem	PDB Article PubMed	2.00E+8	-3.92	n/a	n/a	n/a	n/a	n/a	7.5	20
Universit£ degli Studi di Firenze					Assay Description Inhibition of Helicobacter pylori alpha carbonic anhydrase preincubated for 15 mins by stopped-flow CO2 hydrase assay				Bioorg Med Chem 24: 3413-7 (2016) Article DOI: 10.1016/j.bmc.2016.05.029 BindingDB Entry DOI: 10.7270/Q2W9583B
					More data for this Ligand-Target Pair				3D Structure (crystal)
Carbonic anhydrase 2   (259/259 = 100%)† (Homo sapiens (Human))	BDBM26979 (CHEMBL69710 | Cl- | POTASSIUM CHLORIDE | SODIUM CH...) Show SMILES [Cl-] Show InChI InChI=1S/ClH/h1H/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem	PDB Article PubMed	2.00E+8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Florida Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase-2 by [18O]-exchange mass spectroscopy				Bioorg Med Chem Lett 25: 4937-40 (2015) Article DOI: 10.1016/j.bmcl.2015.05.001 BindingDB Entry DOI: 10.7270/Q2VQ34GP
					More data for this Ligand-Target Pair				3D Structure (crystal)
Carbonic anhydrase 2   (259/259 = 100%)† (Homo sapiens (Human))	BDBM26979 (CHEMBL69710 | Cl- | POTASSIUM CHLORIDE | SODIUM CH...) Show SMILES [Cl-] Show InChI InChI=1S/ClH/h1H/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem	PDB Article PubMed	2.00E+8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Centre Scientifique de Monaco Curated by ChEMBL					Assay Description Inhibition of human recombinant CA2 by stopped-flow CO2 hydration assay				Bioorg Med Chem Lett 21: 710-4 (2011) Checked by Author Article DOI: 10.1016/j.bmcl.2010.11.124 BindingDB Entry DOI: 10.7270/Q26D5T7K
					More data for this Ligand-Target Pair				3D Structure (crystal)
Carbonic anhydrase 2   (259/259 = 100%)† (Homo sapiens (Human))	BDBM26979 (CHEMBL69710 | Cl- | POTASSIUM CHLORIDE | SODIUM CH...) Show SMILES [Cl-] Show InChI InChI=1S/ClH/h1H/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem	PDB Article PubMed	2.00E+8	n/a	n/a	n/a	n/a	n/a	n/a	8.3	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of recombinant human carbonic anhydrase 2 after 15 mins by stopped flow CO2 hydration assay at pH 8.3				Bioorg Med Chem Lett 21: 3591-5 (2011) Article DOI: 10.1016/j.bmcl.2011.04.105 BindingDB Entry DOI: 10.7270/Q2930TGN
					More data for this Ligand-Target Pair				3D Structure (crystal)
Carbonic anhydrase 2   (259/259 = 100%)† (Homo sapiens (Human))	BDBM26979 (CHEMBL69710 | Cl- | POTASSIUM CHLORIDE | SODIUM CH...) Show SMILES [Cl-] Show InChI InChI=1S/ClH/h1H/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem	PDB Article PubMed	2.00E+8	n/a	n/a	n/a	n/a	n/a	n/a	7.5	n/a
Universit£ degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase 2 after 15 mins by CO2 hydrase assay at pH 7.5				Bioorg Med Chem 19: 1847-51 (2011) Article DOI: 10.1016/j.bmc.2011.02.015 BindingDB Entry DOI: 10.7270/Q2QN672R
					More data for this Ligand-Target Pair				3D Structure (crystal)
Carbonic anhydrase 2   (259/259 = 100%)† (Homo sapiens (Human))	BDBM26979 (CHEMBL69710 | Cl- | POTASSIUM CHLORIDE | SODIUM CH...) Show SMILES [Cl-] Show InChI InChI=1S/ClH/h1H/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem	PDB Article PubMed	2.00E+8	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 Inhibitory activity against human carbonic anhydrase II expressed in Escherichia coli				Bioorg Med Chem Lett 14: 5435-9 (2004) Checked by Author Article DOI: 10.1016/j.bmcl.2004.07.086 BindingDB Entry DOI: 10.7270/Q2SN09QF
					More data for this Ligand-Target Pair				3D Structure (crystal)
Carbonic anhydrase 2   (259/259 = 100%)† (Homo sapiens (Human))	BDBM26979 (CHEMBL69710 | Cl- | POTASSIUM CHLORIDE | SODIUM CH...) Show SMILES [Cl-] Show InChI InChI=1S/ClH/h1H/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem	PDB Article PubMed	2.00E+8	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 constant of anion against human carbonic anhydrase isozyme hCA II				Bioorg Med Chem Lett 14: 5769-73 (2004) Article DOI: 10.1016/j.bmcl.2004.09.063 BindingDB Entry DOI: 10.7270/Q24X58JJ
					More data for this Ligand-Target Pair				3D Structure (crystal)
Carbonic anhydrase 2   (259/259 = 100%)† (Homo sapiens (Human))	BDBM26979 (CHEMBL69710 | Cl- | POTASSIUM CHLORIDE | SODIUM CH...) Show SMILES [Cl-] Show InChI InChI=1S/ClH/h1H/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem	PDB Article PubMed	2.00E+8	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 Inhibitory constant against carbonic anhydrase II				Bioorg Med Chem Lett 14: 4563-7 (2004) Article DOI: 10.1016/j.bmcl.2004.06.073 BindingDB Entry DOI: 10.7270/Q2H995ZD
					More data for this Ligand-Target Pair				3D Structure (crystal)
Carbonic anhydrase 2   (259/259 = 100%)† (Homo sapiens (Human))	BDBM26979 (CHEMBL69710 | Cl- | POTASSIUM CHLORIDE | SODIUM CH...) Show SMILES [Cl-] Show InChI InChI=1S/ClH/h1H/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem	PDB Article PubMed	>2.00E+8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Ondokuz Mayis University Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase 2 by Lineweaver-Burk curves				Bioorg Med Chem 19: 744-8 (2011) Article DOI: 10.1016/j.bmc.2010.12.033 BindingDB Entry DOI: 10.7270/Q2ST7QT4
					More data for this Ligand-Target Pair				3D Structure (crystal)
Carbonic anhydrase 2   (259/259 = 100%)† (Homo sapiens (Human))	BDBM26979 (CHEMBL69710 | Cl- | POTASSIUM CHLORIDE | SODIUM CH...) Show SMILES [Cl-] Show InChI InChI=1S/ClH/h1H/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem	PDB Article PubMed	2.00E+8	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 cytosolic carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration assay				Bioorg Med Chem Lett 22: 7142-5 (2012) Article DOI: 10.1016/j.bmcl.2012.09.065 BindingDB Entry DOI: 10.7270/Q2930VB8
					More data for this Ligand-Target Pair				3D Structure (crystal)
Carbonic anhydrase 2   (259/259 = 100%)† (Homo sapiens (Human))	BDBM26979 (CHEMBL69710 | Cl- | POTASSIUM CHLORIDE | SODIUM CH...) Show SMILES [Cl-] Show InChI InChI=1S/ClH/h1H/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MMDB PC cid PC sid PDB UniChem	PDB Article PubMed	2.00E+8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Istituto di Biostrutture e Bioimmagini Curated by ChEMBL					Assay Description Inhibition of human cytosolic carbonic anhydrase-2 preincubated for 15 mins by stopped flow CO2 hydration assay				Bioorg Med Chem Lett 23: 1626-30 (2013) Article DOI: 10.1016/j.bmcl.2013.01.087 BindingDB Entry DOI: 10.7270/Q23X8806
					More data for this Ligand-Target Pair				3D Structure (crystal)
Carbonic anhydrase 2   (259/259 = 100%)† (Homo sapiens (Human))	BDBM50200936 ((9BETA,13ALPHA,14BETA,17ALPHA)-2-METHOXYESTRA-1,3,...) Show SMILES COc1cc2[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CCc2cc1OS(N)(=O)=O)OS(N)(=O)=O |r| Show InChI InChI=1S/C19H28N2O7S2/c1-19-8-7-12-13(15(19)5-6-18(19)28-30(21,24)25)4-3-11-9-17(27-29(20,22)23)16(26-2)10-14(11)12/h9-10,12-13,15,18H,3-8H2,1-2H3,(H2,20,22,23)(H2,21,24,25)/t12-,13+,15-,18-,19-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem Similars	MMDB PDB Article PubMed	n/a	n/a	379	n/a	n/a	n/a	n/a	n/a	n/a
University of Bath Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase 2				J Med Chem 51: 1295-308 (2008) Article DOI: 10.1021/jm701319c BindingDB Entry DOI: 10.7270/Q2M0468S
					More data for this Ligand-Target Pair				3D Structure (crystal)
Carbonic anhydrase 2   (259/259 = 100%)† (Homo sapiens (Human))	BDBM50200936 ((9BETA,13ALPHA,14BETA,17ALPHA)-2-METHOXYESTRA-1,3,...) Show SMILES COc1cc2[C@H]3CC[C@]4(C)[C@H](CC[C@H]4[C@@H]3CCc2cc1OS(N)(=O)=O)OS(N)(=O)=O |r| Show InChI InChI=1S/C19H28N2O7S2/c1-19-8-7-12-13(15(19)5-6-18(19)28-30(21,24)25)4-3-11-9-17(27-29(20,22)23)16(26-2)10-14(11)12/h9-10,12-13,15,18H,3-8H2,1-2H3,(H2,20,22,23)(H2,21,24,25)/t12-,13+,15-,18-,19-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem Similars	MMDB PDB Article PubMed	n/a	n/a	379	n/a	n/a	n/a	n/a	n/a	n/a
University of Bath Curated by ChEMBL					Assay Description Inhibition of human CA2				J Med Chem 49: 7683-96 (2006) Article DOI: 10.1021/jm060705x BindingDB Entry DOI: 10.7270/Q2Z89C2X
					More data for this Ligand-Target Pair				3D Structure (crystal)
Carbonic anhydrase 2   (259/259 = 100%)† (Homo sapiens (Human))	BDBM13426 ((15S)-4-methoxy-15-methyl-5-(sulfamoyloxy)tetracyc...) Show SMILES COc1cc2C3CC[C@]4(C)C(CCC4C3CCc2cc1OS(N)(=O)=O)OS(N)(=O)=O |r| Show InChI InChI=1S/C19H28N2O7S2/c1-19-8-7-12-13(15(19)5-6-18(19)28-30(21,24)25)4-3-11-9-17(27-29(20,22)23)16(26-2)10-14(11)12/h9-10,12-13,15,18H,3-8H2,1-2H3,(H2,20,22,23)(H2,21,24,25)/t12?,13?,15?,18?,19-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	379	n/a	n/a	n/a	n/a	7.8	20
St. Maryamppound39s Hospital					Assay Description The in vitro inhibition of carbonic anhydrase was assessed by a colorimetric assay. Carbonic anhydrase-catalysed hydrolysis of p-nitrophenyl acetate ...				Biochem Biophys Res Commun 305: 909-14 (2003) Article DOI: 10.1016/s0006-291x(03)00865-9 BindingDB Entry DOI: 10.7270/Q2TD9VKK
					More data for this Ligand-Target Pair				3D Structure (crystal)

• Reorder this table by ec50
• Reorder this table by ic50
• Reorder this table by Kd
• Reorder this table by pH
• Reorder this table by T
• Reorder this table by ΔH°
• Reorder this table by -TΔS°
• Change energy units to:  kcal/mole

Search BindingMOAD for More Affinity Data: