BDBM15226 4-(4-{[(2,3,5-tri-O-benzoyl-beta-D-ribofuranosyl)oxy]methyl}-1H-1,2,3-triazol-1-yl)benzenesulfonamide::glycoconjugate sulfonamide 10

SMILES: NS(=O)(=O)c1ccc(cc1)-n1cc(CO[C@@H]2O[C@H](COC(=O)c3ccccc3)[C@@H](OC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)nn1

InChI Key: InChIKey=GTFXZZCYZNZBPR-VLMNPVQYSA-N

Data: 3 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 3 hits for monomerid = 15226   

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))	BDBM15226 (4-(4-{[(2,3,5-tri-O-benzoyl-beta-D-ribofuranosyl)o...) Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(CO[C@@H]2O[C@H](COC(=O)c3ccccc3)[C@@H](OC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)nn1 |r| Show InChI InChI=1S/C35H30N4O10S/c36-50(43,44)28-18-16-27(17-19-28)39-20-26(37-38-39)21-46-35-31(49-34(42)25-14-8-3-9-15-25)30(48-33(41)24-12-6-2-7-13-24)29(47-35)22-45-32(40)23-10-4-1-5-11-23/h1-20,29-31,35H,21-22H2,(H2,36,43,44)/t29-,30-,31-,35-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	7.60	-11.1	n/a	n/a	n/a	n/a	n/a	7.5	25
Griffith University					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...				J Med Chem 50: 1651-7 (2007) Article DOI: 10.1021/jm061320h BindingDB Entry DOI: 10.7270/Q2668BFJ
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM15226 (4-(4-{[(2,3,5-tri-O-benzoyl-beta-D-ribofuranosyl)o...) Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(CO[C@@H]2O[C@H](COC(=O)c3ccccc3)[C@@H](OC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)nn1 |r| Show InChI InChI=1S/C35H30N4O10S/c36-50(43,44)28-18-16-27(17-19-28)39-20-26(37-38-39)21-46-35-31(49-34(42)25-14-8-3-9-15-25)30(48-33(41)24-12-6-2-7-13-24)29(47-35)22-45-32(40)23-10-4-1-5-11-23/h1-20,29-31,35H,21-22H2,(H2,36,43,44)/t29-,30-,31-,35-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	84	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Griffith University					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...				J Med Chem 50: 1651-7 (2007) Article DOI: 10.1021/jm061320h BindingDB Entry DOI: 10.7270/Q2668BFJ
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM15226 (4-(4-{[(2,3,5-tri-O-benzoyl-beta-D-ribofuranosyl)o...) Show SMILES NS(=O)(=O)c1ccc(cc1)-n1cc(CO[C@@H]2O[C@H](COC(=O)c3ccccc3)[C@@H](OC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)nn1 |r| Show InChI InChI=1S/C35H30N4O10S/c36-50(43,44)28-18-16-27(17-19-28)39-20-26(37-38-39)21-46-35-31(49-34(42)25-14-8-3-9-15-25)30(48-33(41)24-12-6-2-7-13-24)29(47-35)22-45-32(40)23-10-4-1-5-11-23/h1-20,29-31,35H,21-22H2,(H2,36,43,44)/t29-,30-,31-,35-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	5.20E+3	-7.20	n/a	n/a	n/a	n/a	n/a	7.5	25
Griffith University					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...				J Med Chem 50: 1651-7 (2007) Article DOI: 10.1021/jm061320h BindingDB Entry DOI: 10.7270/Q2668BFJ
					More data for this Ligand-Target Pair