null

SMILES: CCOC(=O)[C@@H]1C[C@H]1Cc1cc(OC)c(OC)cc1Br

InChI Key: InChIKey=CLCFASDATULIBW-MWLCHTKSSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50233546   

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))	BDBM50233546 (CHEMBL4087756) Show SMILES CCOC(=O)[C@@H]1C[C@H]1Cc1cc(OC)c(OC)cc1Br |r| Show InChI InChI=1S/C15H19BrO4/c1-4-20-15(17)11-6-9(11)5-10-7-13(18-2)14(19-3)8-12(10)16/h7-9,11H,4-6H2,1-3H3/t9-,11-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	4.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Atat£rk University Curated by ChEMBL					Assay Description Inhibition of human CA1 using para-nitrophenylacetate as substrate measured over 3 mins by UV-vis spectrophotometric method				J Med Chem 58: 640-50 (2015) BindingDB Entry DOI: 10.7270/Q2PR7Z6B
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50233546 (CHEMBL4087756) Show SMILES CCOC(=O)[C@@H]1C[C@H]1Cc1cc(OC)c(OC)cc1Br |r| Show InChI InChI=1S/C15H19BrO4/c1-4-20-15(17)11-6-9(11)5-10-7-13(18-2)14(19-3)8-12(10)16/h7-9,11H,4-6H2,1-3H3/t9-,11-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	8.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Atat£rk University Curated by ChEMBL					Assay Description Inhibition of human CA2 using para-nitrophenylacetate as substrate measured over 3 mins by UV-vis spectrophotometric method				J Med Chem 58: 640-50 (2015) BindingDB Entry DOI: 10.7270/Q2PR7Z6B
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50233546 (CHEMBL4087756) Show SMILES CCOC(=O)[C@@H]1C[C@H]1Cc1cc(OC)c(OC)cc1Br |r| Show InChI InChI=1S/C15H19BrO4/c1-4-20-15(17)11-6-9(11)5-10-7-13(18-2)14(19-3)8-12(10)16/h7-9,11H,4-6H2,1-3H3/t9-,11-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	7.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Atat£rk University Curated by ChEMBL					Assay Description Inhibition of human CA9 by stopped-flow CO2 hydration method				J Med Chem 58: 640-50 (2015) BindingDB Entry DOI: 10.7270/Q2PR7Z6B
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50233546 (CHEMBL4087756) Show SMILES CCOC(=O)[C@@H]1C[C@H]1Cc1cc(OC)c(OC)cc1Br |r| Show InChI InChI=1S/C15H19BrO4/c1-4-20-15(17)11-6-9(11)5-10-7-13(18-2)14(19-3)8-12(10)16/h7-9,11H,4-6H2,1-3H3/t9-,11-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Atat£rk University Curated by ChEMBL					Assay Description Inhibition of human CA12 by stopped-flow CO2 hydration method				J Med Chem 58: 640-50 (2015) BindingDB Entry DOI: 10.7270/Q2PR7Z6B
					More data for this Ligand-Target Pair