BDBM50278779 4-(4-{[2',3',4',6'-Tetra-O-acetyl-beta-D-glucopyranosyl]sulfinylmethyl}-1-H-1,2,3-triazol-1-yl)benzenesulfonamide::CHEMBL480302

SMILES: CC(=O)OC[C@H]1O[C@H]([C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O)S(=O)Cc1cn(nn1)-c1ccc(cc1)S(N)(=O)=O

InChI Key: InChIKey=RZSYRRUMXADKCN-AKZNPFCJSA-N

Data: 4 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50278779   

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 2 (Homo sapiens (Human))	BDBM50278779 (4-(4-{[2',3',4',6'-Tetra-O-acetyl-beta-D-glucopyra...) Show SMILES CC(=O)OC[C@H]1O[C@H]([C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O)S(=O)Cc1cn(nn1)-c1ccc(cc1)S(N)(=O)=O |r| Show InChI InChI=1S/C23H28N4O12S2/c1-12(28)35-10-19-20(36-13(2)29)21(37-14(3)30)22(38-15(4)31)23(39-19)40(32)11-16-9-27(26-25-16)17-5-7-18(8-6-17)41(24,33)34/h5-9,19-23H,10-11H2,1-4H3,(H2,24,33,34)/t19-,20-,21+,22-,23+,40?/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.40	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 recombinant CA2 by stopped flow CO2 hydration assay				Bioorg Med Chem Lett 19: 2273-6 (2009) Article DOI: 10.1016/j.bmcl.2009.02.086 BindingDB Entry DOI: 10.7270/Q2QF8TSW
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50278779 (4-(4-{[2',3',4',6'-Tetra-O-acetyl-beta-D-glucopyra...) Show SMILES CC(=O)OC[C@H]1O[C@H]([C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O)S(=O)Cc1cn(nn1)-c1ccc(cc1)S(N)(=O)=O |r| Show InChI InChI=1S/C23H28N4O12S2/c1-12(28)35-10-19-20(36-13(2)29)21(37-14(3)30)22(38-15(4)31)23(39-19)40(32)11-16-9-27(26-25-16)17-5-7-18(8-6-17)41(24,33)34/h5-9,19-23H,10-11H2,1-4H3,(H2,24,33,34)/t19-,20-,21+,22-,23+,40?/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8.40	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 recombinant CA12 by stopped flow CO2 hydration assay				Bioorg Med Chem Lett 19: 2273-6 (2009) Article DOI: 10.1016/j.bmcl.2009.02.086 BindingDB Entry DOI: 10.7270/Q2QF8TSW
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50278779 (4-(4-{[2',3',4',6'-Tetra-O-acetyl-beta-D-glucopyra...) Show SMILES CC(=O)OC[C@H]1O[C@H]([C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O)S(=O)Cc1cn(nn1)-c1ccc(cc1)S(N)(=O)=O |r| Show InChI InChI=1S/C23H28N4O12S2/c1-12(28)35-10-19-20(36-13(2)29)21(37-14(3)30)22(38-15(4)31)23(39-19)40(32)11-16-9-27(26-25-16)17-5-7-18(8-6-17)41(24,33)34/h5-9,19-23H,10-11H2,1-4H3,(H2,24,33,34)/t19-,20-,21+,22-,23+,40?/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9.90	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 recombinant CA9 by stopped flow CO2 hydration assay				Bioorg Med Chem Lett 19: 2273-6 (2009) Article DOI: 10.1016/j.bmcl.2009.02.086 BindingDB Entry DOI: 10.7270/Q2QF8TSW
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50278779 (4-(4-{[2',3',4',6'-Tetra-O-acetyl-beta-D-glucopyra...) Show SMILES CC(=O)OC[C@H]1O[C@H]([C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O)S(=O)Cc1cn(nn1)-c1ccc(cc1)S(N)(=O)=O |r| Show InChI InChI=1S/C23H28N4O12S2/c1-12(28)35-10-19-20(36-13(2)29)21(37-14(3)30)22(38-15(4)31)23(39-19)40(32)11-16-9-27(26-25-16)17-5-7-18(8-6-17)41(24,33)34/h5-9,19-23H,10-11H2,1-4H3,(H2,24,33,34)/t19-,20-,21+,22-,23+,40?/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	103	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 recombinant CA1 by stopped flow CO2 hydration assay				Bioorg Med Chem Lett 19: 2273-6 (2009) Article DOI: 10.1016/j.bmcl.2009.02.086 BindingDB Entry DOI: 10.7270/Q2QF8TSW
					More data for this Ligand-Target Pair