BDBM246589 N-((4,5-dimethoxy-2-methylphenyl)(3,4-dimethoxyphenyl)methyl)methane sulfonamide (27)

SMILES: COc1ccc(cc1OC)C(NS(C)(=O)=O)c1cc(OC)c(OC)cc1C

InChI Key: InChIKey=SZZMAQICRJAMRA-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 246589   

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))	BDBM246589 (N-((4,5-dimethoxy-2-methylphenyl)(3,4-dimethoxyphe...) Show SMILES COc1ccc(cc1OC)C(NS(C)(=O)=O)c1cc(OC)c(OC)cc1C Show InChI InChI=1S/C19H25NO6S/c1-12-9-16(24-3)18(26-5)11-14(12)19(20-27(6,21)22)13-7-8-15(23-2)17(10-13)25-4/h7-11,19-20H,1-6H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.90E+4	-6.44	n/a	n/a	n/a	n/a	n/a	7.4	25
Atatürk University					Assay Description CA activity was assayed by following the change in absorbance at 348 nm of 4-nitrophenylacetate (NPA) to 4-nitrophenylate ion over a period of 3 min ...				J Enzyme Inhib Med Chem 29: 168-74 (2014) Article DOI: 10.3109/14756366.2012.763163 BindingDB Entry DOI: 10.7270/Q2H99447
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM246589 (N-((4,5-dimethoxy-2-methylphenyl)(3,4-dimethoxyphe...) Show SMILES COc1ccc(cc1OC)C(NS(C)(=O)=O)c1cc(OC)c(OC)cc1C Show InChI InChI=1S/C19H25NO6S/c1-12-9-16(24-3)18(26-5)11-14(12)19(20-27(6,21)22)13-7-8-15(23-2)17(10-13)25-4/h7-11,19-20H,1-6H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	4.86E+4	-5.88	n/a	n/a	n/a	n/a	n/a	7.4	25
Atatürk University					Assay Description CA activity was assayed by following the change in absorbance at 348 nm of 4-nitrophenylacetate (NPA) to 4-nitrophenylate ion over a period of 3 min ...				J Enzyme Inhib Med Chem 29: 168-74 (2014) Article DOI: 10.3109/14756366.2012.763163 BindingDB Entry DOI: 10.7270/Q2H99447
					More data for this Ligand-Target Pair