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SMILES: Cc1ccc(cc1S(N)(=O)=O)-c1cnc(o1)C1CC1

InChI Key: InChIKey=ZOGPNHMBZBNCEJ-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50114864   

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))	BDBM50114864 (CHEMBL3608876) Show SMILES Cc1ccc(cc1S(N)(=O)=O)-c1cnc(o1)C1CC1 Show InChI InChI=1S/C13H14N2O3S/c1-8-2-3-10(6-12(8)19(14,16)17)11-7-15-13(18-11)9-4-5-9/h2-3,6-7,9H,4-5H2,1H3,(H2,14,16,17)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	64	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Saint Petersburg State University Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration method				Eur J Med Chem 101: 334-47 (2015) BindingDB Entry DOI: 10.7270/Q2W95BZC
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50114864 (CHEMBL3608876) Show SMILES Cc1ccc(cc1S(N)(=O)=O)-c1cnc(o1)C1CC1 Show InChI InChI=1S/C13H14N2O3S/c1-8-2-3-10(6-12(8)19(14,16)17)11-7-15-13(18-11)9-4-5-9/h2-3,6-7,9H,4-5H2,1H3,(H2,14,16,17)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	289	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Saint Petersburg State University Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase 1 preincubated for 15 mins by stopped flow CO2 hydration method				Eur J Med Chem 101: 334-47 (2015) BindingDB Entry DOI: 10.7270/Q2W95BZC
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50114864 (CHEMBL3608876) Show SMILES Cc1ccc(cc1S(N)(=O)=O)-c1cnc(o1)C1CC1 Show InChI InChI=1S/C13H14N2O3S/c1-8-2-3-10(6-12(8)19(14,16)17)11-7-15-13(18-11)9-4-5-9/h2-3,6-7,9H,4-5H2,1H3,(H2,14,16,17)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	318	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Saint Petersburg State University Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase 9 preincubated for 15 mins by stopped flow CO2 hydration method				Eur J Med Chem 101: 334-47 (2015) BindingDB Entry DOI: 10.7270/Q2W95BZC
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50114864 (CHEMBL3608876) Show SMILES Cc1ccc(cc1S(N)(=O)=O)-c1cnc(o1)C1CC1 Show InChI InChI=1S/C13H14N2O3S/c1-8-2-3-10(6-12(8)19(14,16)17)11-7-15-13(18-11)9-4-5-9/h2-3,6-7,9H,4-5H2,1H3,(H2,14,16,17)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	381	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Saint Petersburg State University Curated by ChEMBL					Assay Description Inhibition of human recombinant carbonic anhydrase 12 preincubated for 15 mins by stopped flow CO2 hydration method				Eur J Med Chem 101: 334-47 (2015) BindingDB Entry DOI: 10.7270/Q2W95BZC
					More data for this Ligand-Target Pair