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SMILES: Clc1ccc(cc1)C(=O)Nc1ccc2C(=O)NS(=O)(=O)c2c1

InChI Key: InChIKey=OOYBCPPBTLJUSQ-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 50532428   

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 12 (Homo sapiens (Human))	BDBM50532428 (CHEMBL4572367) Show SMILES Clc1ccc(cc1)C(=O)Nc1ccc2C(=O)NS(=O)(=O)c2c1 Show InChI InChI=1S/C14H9ClN2O4S/c15-9-3-1-8(2-4-9)13(18)16-10-5-6-11-12(7-10)22(20,21)17-14(11)19/h1-7H,(H,16,18)(H,17,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	8.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Pisa Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase 12 preincubated for 15 mins by stopped flow CO2 hydration assay				J Med Chem 59: 6547-52 (2016) Article DOI: 10.1021/acs.jmedchem.6b00616
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50532428 (CHEMBL4572367) Show SMILES Clc1ccc(cc1)C(=O)Nc1ccc2C(=O)NS(=O)(=O)c2c1 Show InChI InChI=1S/C14H9ClN2O4S/c15-9-3-1-8(2-4-9)13(18)16-10-5-6-11-12(7-10)22(20,21)17-14(11)19/h1-7H,(H,16,18)(H,17,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	8.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Pisa Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase 12 preincubated for 15 mins by stopped flow CO2 hydration assay				J Med Chem 59: 6547-52 (2016) Article DOI: 10.1021/acs.jmedchem.6b00616
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50532428 (CHEMBL4572367) Show SMILES Clc1ccc(cc1)C(=O)Nc1ccc2C(=O)NS(=O)(=O)c2c1 Show InChI InChI=1S/C14H9ClN2O4S/c15-9-3-1-8(2-4-9)13(18)16-10-5-6-11-12(7-10)22(20,21)17-14(11)19/h1-7H,(H,16,18)(H,17,19)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.92E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Pisa Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase 9 catalytic site preincubated for 15 mins by stopped flow CO2 hydration assay				J Med Chem 59: 6547-52 (2016) Article DOI: 10.1021/acs.jmedchem.6b00616
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50532428 (CHEMBL4572367) Show SMILES Clc1ccc(cc1)C(=O)Nc1ccc2C(=O)NS(=O)(=O)c2c1 Show InChI InChI=1S/C14H9ClN2O4S/c15-9-3-1-8(2-4-9)13(18)16-10-5-6-11-12(7-10)22(20,21)17-14(11)19/h1-7H,(H,16,18)(H,17,19)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.92E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Pisa Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase 9 catalytic site preincubated for 15 mins by stopped flow CO2 hydration assay				J Med Chem 59: 6547-52 (2016) Article DOI: 10.1021/acs.jmedchem.6b00616
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50532428 (CHEMBL4572367) Show SMILES Clc1ccc(cc1)C(=O)Nc1ccc2C(=O)NS(=O)(=O)c2c1 Show InChI InChI=1S/C14H9ClN2O4S/c15-9-3-1-8(2-4-9)13(18)16-10-5-6-11-12(7-10)22(20,21)17-14(11)19/h1-7H,(H,16,18)(H,17,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	4.67E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Pisa Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration assay				J Med Chem 59: 6547-52 (2016) Article DOI: 10.1021/acs.jmedchem.6b00616
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50532428 (CHEMBL4572367) Show SMILES Clc1ccc(cc1)C(=O)Nc1ccc2C(=O)NS(=O)(=O)c2c1 Show InChI InChI=1S/C14H9ClN2O4S/c15-9-3-1-8(2-4-9)13(18)16-10-5-6-11-12(7-10)22(20,21)17-14(11)19/h1-7H,(H,16,18)(H,17,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	4.67E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Pisa Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration assay				J Med Chem 59: 6547-52 (2016) Article DOI: 10.1021/acs.jmedchem.6b00616
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50532428 (CHEMBL4572367) Show SMILES Clc1ccc(cc1)C(=O)Nc1ccc2C(=O)NS(=O)(=O)c2c1 Show InChI InChI=1S/C14H9ClN2O4S/c15-9-3-1-8(2-4-9)13(18)16-10-5-6-11-12(7-10)22(20,21)17-14(11)19/h1-7H,(H,16,18)(H,17,19)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Pisa Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase 1 preincubated for 15 mins by stopped flow CO2 hydration assay				J Med Chem 59: 6547-52 (2016) Article DOI: 10.1021/acs.jmedchem.6b00616
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50532428 (CHEMBL4572367) Show SMILES Clc1ccc(cc1)C(=O)Nc1ccc2C(=O)NS(=O)(=O)c2c1 Show InChI InChI=1S/C14H9ClN2O4S/c15-9-3-1-8(2-4-9)13(18)16-10-5-6-11-12(7-10)22(20,21)17-14(11)19/h1-7H,(H,16,18)(H,17,19)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Pisa Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase 1 preincubated for 15 mins by stopped flow CO2 hydration assay				J Med Chem 59: 6547-52 (2016) Article DOI: 10.1021/acs.jmedchem.6b00616
					More data for this Ligand-Target Pair