null

SMILES: CC(=O)c1ccc2oc(cc2c1O)-c1coc2ccc(C(C)=O)c(O)c12

InChI Key: InChIKey=OOMZWMYSDVPPNA-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50198352   

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
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50198352 (1-(5-acetyl-6,6'-dihydroxy-2',3'-dihydro-[2,3']-bi...) Show SMILES CC(=O)c1ccc2oc(cc2c1O)-c1coc2ccc(C(C)=O)c(O)c12 Show InChI InChI=1S/C20H14O6/c1-9(21)11-3-5-15-13(19(11)23)7-17(26-15)14-8-25-16-6-4-12(10(2)22)20(24)18(14)16/h3-8,23-24H,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.75E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Central Drug Research Institute Curated by ChEMBL					Assay Description Inhibition of PTP1B in presence of 0.01% Triton X-100				Bioorg Med Chem 15: 727-34 (2006) Article DOI: 10.1016/j.bmc.2006.10.053 BindingDB Entry DOI: 10.7270/Q2CR5T1W
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50198352 (1-(5-acetyl-6,6'-dihydroxy-2',3'-dihydro-[2,3']-bi...) Show SMILES CC(=O)c1ccc2oc(cc2c1O)-c1coc2ccc(C(C)=O)c(O)c12 Show InChI InChI=1S/C20H14O6/c1-9(21)11-3-5-15-13(19(11)23)7-17(26-15)14-8-25-16-6-4-12(10(2)22)20(24)18(14)16/h3-8,23-24H,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.50E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Central Drug Research Institute Curated by ChEMBL					Assay Description Inhibition of PTP1B				Bioorg Med Chem 15: 727-34 (2006) Article DOI: 10.1016/j.bmc.2006.10.053 BindingDB Entry DOI: 10.7270/Q2CR5T1W
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50198352 (1-(5-acetyl-6,6'-dihydroxy-2',3'-dihydro-[2,3']-bi...) Show SMILES CC(=O)c1ccc2oc(cc2c1O)-c1coc2ccc(C(C)=O)c(O)c12 Show InChI InChI=1S/C20H14O6/c1-9(21)11-3-5-15-13(19(11)23)7-17(26-15)14-8-25-16-6-4-12(10(2)22)20(24)18(14)16/h3-8,23-24H,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
Central Drug Research Institute Curated by ChEMBL					Assay Description Inhibition of PTP1B				Bioorg Med Chem 15: 727-34 (2006) Article DOI: 10.1016/j.bmc.2006.10.053 BindingDB Entry DOI: 10.7270/Q2CR5T1W
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50198352 (1-(5-acetyl-6,6'-dihydroxy-2',3'-dihydro-[2,3']-bi...) Show SMILES CC(=O)c1ccc2oc(cc2c1O)-c1coc2ccc(C(C)=O)c(O)c12 Show InChI InChI=1S/C20H14O6/c1-9(21)11-3-5-15-13(19(11)23)7-17(26-15)14-8-25-16-6-4-12(10(2)22)20(24)18(14)16/h3-8,23-24H,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.88E+4	n/a	n/a	n/a	n/a	n/a	n/a
Central Drug Research Institute Curated by ChEMBL					Assay Description Inhibition of PTP1B in presence of 0.01% Triton X-100				Bioorg Med Chem 15: 727-34 (2006) Article DOI: 10.1016/j.bmc.2006.10.053 BindingDB Entry DOI: 10.7270/Q2CR5T1W
					More data for this Ligand-Target Pair