BindingDB PrimarySearch

BDBM50056315 CHEBI:17558::QUERCITRIN::Quercitrin

SMILES: C[C@@H]1O[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)-c2ccc(O)c(O)c2)[C@H](O)[C@H](O)[C@H]1O

InChI Key: InChIKey=OXGUCUVFOIWWQJ-HQBVPOQASA-N

Data: 7 IC50

PDB links: 2 PDB IDs match this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 9 hits for monomerid = 50056315
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
EBifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50056315 (CHEBI:17558 \| QUERCITRIN \| Quercitrin) Show SMILES Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid PDB UniChem Similars		3.96E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus (strain A/USSR/90/1977 H1N1))	BDBM50056315 (CHEBI:17558 \| QUERCITRIN \| Quercitrin) Show SMILES Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	1.09E+5	n/a	n/a	n/a	n/a	n/a	n/a
Freie Universitaet Berlin Curated by ChEMBL					Assay Description Inhibition of influenza A virus (A/California/07/2009(H1N1)) pdm09 neuraminidase using MUNANA substrate pre-incubated for 30 mins before substrate ad...				Bioorg Med Chem Lett 24: 4312-7 (2014) Article DOI: 10.1016/j.bmcl.2014.07.010 BindingDB Entry DOI: 10.7270/Q2BC4164
Freie Universitaet Berlin Curated by ChEMBL					More data for this Ligand-Target Pair
Protein-tyrosine phosphatase 1B (Homo sapiens (Human))	BDBM50056315 (CHEBI:17558 \| QUERCITRIN \| Quercitrin) Show SMILES Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition of PTP1B (unknown origin) using pNPP substrate measured after 3 mins by colorimetric assay				Bioorg Med Chem Lett 25: 2028-32 (2015) Article DOI: 10.1016/j.bmcl.2015.04.003 BindingDB Entry DOI: 10.7270/Q2XP76M3
Chinese Academy of Sciences Curated by ChEMBL					More data for this Ligand-Target Pair
Tyrosinase (Agaricus bisporus (Common mushroom))	BDBM50056315 (CHEBI:17558 \| QUERCITRIN \| Quercitrin) Show SMILES Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	1.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Pretoria Curated by ChEMBL					Assay Description Inhibition of mushroom tyrosinase using L-tyrosine as substrate pretreated for 5 mins followed by substrate addition measured over 30 mins by spectro...				J Nat Prod 81: 49-56 (2018) Article DOI: 10.1021/acs.jnatprod.7b00564 BindingDB Entry DOI: 10.7270/Q2H70JBS
University of Pretoria Curated by ChEMBL					More data for this Ligand-Target Pair
Integrase (Human immunodeficiency virus 1)	BDBM50056315 (CHEBI:17558 \| QUERCITRIN \| Quercitrin) Show SMILES Show InChI	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	1.67E+5	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science & Technology Curated by ChEMBL					Assay Description Inhibition of HIV1 recombinant integrase expressed in Escherichia coli				J Nat Prod 61: 145-8 (1998) Article DOI: 10.1021/np970171q BindingDB Entry DOI: 10.7270/Q2V127NW
Korea Institute of Science & Technology Curated by ChEMBL					More data for this Ligand-Target Pair
Nonstructural protein 5 (Dengue virus)	BDBM50056315 (CHEBI:17558 \| QUERCITRIN \| Quercitrin) Show SMILES Show InChI	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	1.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Queensland University of Technology Curated by ChEMBL					Assay Description Inhibition of dengue virus NS5 RNA dependent RNA polymerase				Eur J Med Chem 176: 431-455 (2019) Article DOI: 10.1016/j.ejmech.2019.05.010
Queensland University of Technology Curated by ChEMBL					More data for this Ligand-Target Pair
EBifunctional epoxide hydrolase 2 (Homo sapiens (Human))	BDBM50056315 (CHEBI:17558 \| QUERCITRIN \| Quercitrin) Show SMILES Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid PDB UniChem Similars		n/a	n/a	1.18E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
TBA					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus (strain A/USSR/90/1977 H1N1))	BDBM50056315 (CHEBI:17558 \| QUERCITRIN \| Quercitrin) Show SMILES Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	1.21E+5	n/a	n/a	n/a	n/a	n/a	n/a
Freie Universitaet Berlin Curated by ChEMBL					Assay Description Inhibition of influenza A virus (A/Perth/16/2009(H3N2)) neuraminidase using MUNANA substrate pre-incubated for 30 mins before substrate addition by f...				Bioorg Med Chem Lett 24: 4312-7 (2014) Article DOI: 10.1016/j.bmcl.2014.07.010 BindingDB Entry DOI: 10.7270/Q2BC4164
Freie Universitaet Berlin Curated by ChEMBL					More data for this Ligand-Target Pair
Tyrosinase (Agaricus bisporus (Common mushroom))	BDBM50056315 (CHEBI:17558 \| QUERCITRIN \| Quercitrin) Show SMILES Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Pretoria Curated by ChEMBL					Assay Description Inhibition of mushroom tyrosinase				J Nat Prod 81: 49-56 (2018) Article DOI: 10.1021/acs.jnatprod.7b00564 BindingDB Entry DOI: 10.7270/Q2H70JBS
University of Pretoria Curated by ChEMBL					More data for this Ligand-Target Pair