null

SMILES: CC(=O)N[C@@H]1[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](COC(C)=O)O[C@H]1n1cc(nn1)-c1ccc(cc1)S(N)(=O)=O

InChI Key: InChIKey=OQSUEVFKDJXJHM-ZGJYDULXSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50372671   

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))	BDBM50372671 (CHEMBL270994) Show SMILES CC(=O)N[C@@H]1[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](COC(C)=O)O[C@H]1n1cc(nn1)-c1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C22H27N5O10S/c1-11(28)24-19-21(36-14(4)31)20(35-13(3)30)18(10-34-12(2)29)37-22(19)27-9-17(25-26-27)15-5-7-16(8-6-15)38(23,32)33/h5-9,18-22H,10H2,1-4H3,(H,24,28)(H2,23,32,33)/t18-,19-,20-,21-,22-/m1/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	101	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 CA9 catalytic domain by CO2 hydration method				J Med Chem 51: 1945-53 (2008) Article DOI: 10.1021/jm701426t BindingDB Entry DOI: 10.7270/Q28P61CM
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50372671 (CHEMBL270994) Show SMILES CC(=O)N[C@@H]1[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](COC(C)=O)O[C@H]1n1cc(nn1)-c1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C22H27N5O10S/c1-11(28)24-19-21(36-14(4)31)20(35-13(3)30)18(10-34-12(2)29)37-22(19)27-9-17(25-26-27)15-5-7-16(8-6-15)38(23,32)33/h5-9,18-22H,10H2,1-4H3,(H,24,28)(H2,23,32,33)/t18-,19-,20-,21-,22-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	440	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 CO2 hydration method				J Med Chem 51: 1945-53 (2008) Article DOI: 10.1021/jm701426t BindingDB Entry DOI: 10.7270/Q28P61CM
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50372671 (CHEMBL270994) Show SMILES CC(=O)N[C@@H]1[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](COC(C)=O)O[C@H]1n1cc(nn1)-c1ccc(cc1)S(N)(=O)=O Show InChI InChI=1S/C22H27N5O10S/c1-11(28)24-19-21(36-14(4)31)20(35-13(3)30)18(10-34-12(2)29)37-22(19)27-9-17(25-26-27)15-5-7-16(8-6-15)38(23,32)33/h5-9,18-22H,10H2,1-4H3,(H,24,28)(H2,23,32,33)/t18-,19-,20-,21-,22-/m1/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	5.00E+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 CO2 hydration method				J Med Chem 51: 1945-53 (2008) Article DOI: 10.1021/jm701426t BindingDB Entry DOI: 10.7270/Q28P61CM
					More data for this Ligand-Target Pair