null

SMILES: COc1ccc(OC)c(NC(=O)Nc2ccc(NS(N)(=O)=O)cc2)c1

InChI Key: InChIKey=OJJJQCPLBGTLKH-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50428616   

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 1 (Homo sapiens (Human))	BDBM50428616 (CHEMBL2331758) Show SMILES COc1ccc(OC)c(NC(=O)Nc2ccc(NS(N)(=O)=O)cc2)c1 Show InChI InChI=1S/C15H18N4O5S/c1-23-12-7-8-14(24-2)13(9-12)18-15(20)17-10-3-5-11(6-4-10)19-25(16,21)22/h3-9,19H,1-2H3,(H2,16,21,22)(H2,17,18,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	0.978	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Romanian Academy Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase-1				Bioorg Med Chem 21: 1404-9 (2013) Article DOI: 10.1016/j.bmc.2012.11.004 BindingDB Entry DOI: 10.7270/Q2XW4M4Q
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50428616 (CHEMBL2331758) Show SMILES COc1ccc(OC)c(NC(=O)Nc2ccc(NS(N)(=O)=O)cc2)c1 Show InChI InChI=1S/C15H18N4O5S/c1-23-12-7-8-14(24-2)13(9-12)18-15(20)17-10-3-5-11(6-4-10)19-25(16,21)22/h3-9,19H,1-2H3,(H2,16,21,22)(H2,17,18,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Romanian Academy Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase-2				Bioorg Med Chem 21: 1404-9 (2013) Article DOI: 10.1016/j.bmc.2012.11.004 BindingDB Entry DOI: 10.7270/Q2XW4M4Q
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50428616 (CHEMBL2331758) Show SMILES COc1ccc(OC)c(NC(=O)Nc2ccc(NS(N)(=O)=O)cc2)c1 Show InChI InChI=1S/C15H18N4O5S/c1-23-12-7-8-14(24-2)13(9-12)18-15(20)17-10-3-5-11(6-4-10)19-25(16,21)22/h3-9,19H,1-2H3,(H2,16,21,22)(H2,17,18,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	2.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Romanian Academy Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase-9				Bioorg Med Chem 21: 1404-9 (2013) Article DOI: 10.1016/j.bmc.2012.11.004 BindingDB Entry DOI: 10.7270/Q2XW4M4Q
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50428616 (CHEMBL2331758) Show SMILES COc1ccc(OC)c(NC(=O)Nc2ccc(NS(N)(=O)=O)cc2)c1 Show InChI InChI=1S/C15H18N4O5S/c1-23-12-7-8-14(24-2)13(9-12)18-15(20)17-10-3-5-11(6-4-10)19-25(16,21)22/h3-9,19H,1-2H3,(H2,16,21,22)(H2,17,18,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	2.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Romanian Academy Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase-12				Bioorg Med Chem 21: 1404-9 (2013) Article DOI: 10.1016/j.bmc.2012.11.004 BindingDB Entry DOI: 10.7270/Q2XW4M4Q
					More data for this Ligand-Target Pair