null

SMILES: COC(=O)[C@H]1O[C@H]([C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O)S(N)(=O)=O

InChI Key: InChIKey=CYLSCOJEVMRAAT-OBBGECFZSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50299575   

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 9 (Homo sapiens (Human))	BDBM50299575 ((2S,3S,4S,5R,6S)-2-(methoxycarbonyl)-6-sulfamoylte...) Show SMILES COC(=O)[C@H]1O[C@H]([C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O)S(N)(=O)=O |r| Show InChI InChI=1S/C13H19NO11S/c1-5(15)22-8-9(23-6(2)16)11(24-7(3)17)13(26(14,19)20)25-10(8)12(18)21-4/h8-11,13H,1-4H3,(H2,14,19,20)/t8-,9-,10-,11+,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	4.15E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Griffith University Curated by ChEMBL					Assay Description Inhibition of human cloned CA9 catalytic domain by stopped flow CO2 hydration assay				J Med Chem 52: 6421-32 (2009) Article DOI: 10.1021/jm900914e BindingDB Entry DOI: 10.7270/Q2N29XV0
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50299575 ((2S,3S,4S,5R,6S)-2-(methoxycarbonyl)-6-sulfamoylte...) Show SMILES COC(=O)[C@H]1O[C@H]([C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O)S(N)(=O)=O |r| Show InChI InChI=1S/C13H19NO11S/c1-5(15)22-8-9(23-6(2)16)11(24-7(3)17)13(26(14,19)20)25-10(8)12(18)21-4/h8-11,13H,1-4H3,(H2,14,19,20)/t8-,9-,10-,11+,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	4.34E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Griffith University Curated by ChEMBL					Assay Description Inhibition of human cloned CA1 by stopped flow CO2 hydration assay				J Med Chem 52: 6421-32 (2009) Article DOI: 10.1021/jm900914e BindingDB Entry DOI: 10.7270/Q2N29XV0
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50299575 ((2S,3S,4S,5R,6S)-2-(methoxycarbonyl)-6-sulfamoylte...) Show SMILES COC(=O)[C@H]1O[C@H]([C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O)S(N)(=O)=O |r| Show InChI InChI=1S/C13H19NO11S/c1-5(15)22-8-9(23-6(2)16)11(24-7(3)17)13(26(14,19)20)25-10(8)12(18)21-4/h8-11,13H,1-4H3,(H2,14,19,20)/t8-,9-,10-,11+,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	4.35E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Griffith University Curated by ChEMBL					Assay Description Inhibition of human cloned CA2 by stopped flow CO2 hydration assay				J Med Chem 52: 6421-32 (2009) Article DOI: 10.1021/jm900914e BindingDB Entry DOI: 10.7270/Q2N29XV0
					More data for this Ligand-Target Pair				3D Structure (docked)
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50299575 ((2S,3S,4S,5R,6S)-2-(methoxycarbonyl)-6-sulfamoylte...) Show SMILES COC(=O)[C@H]1O[C@H]([C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O)S(N)(=O)=O |r| Show InChI InChI=1S/C13H19NO11S/c1-5(15)22-8-9(23-6(2)16)11(24-7(3)17)13(26(14,19)20)25-10(8)12(18)21-4/h8-11,13H,1-4H3,(H2,14,19,20)/t8-,9-,10-,11+,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	4.71E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Griffith University Curated by ChEMBL					Assay Description Inhibition of human cloned CA12 catalytic domain by stopped flow CO2 hydration assay				J Med Chem 52: 6421-32 (2009) Article DOI: 10.1021/jm900914e BindingDB Entry DOI: 10.7270/Q2N29XV0
					More data for this Ligand-Target Pair