BDBM50331544 7H-furo[3,2-g]chromen-7-one::CHEMBL164660::Furo[3,2-g]chromen-7-one::psoralen
SMILES: O=c1ccc2cc3ccoc3cc2o1
InChI Key: InChIKey=ZCCUUQDIBDJBTK-UHFFFAOYSA-N
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 |
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Cytochrome P450 2A6 (Homo sapiens (Human)) | BDBM50331544 (7H-furo[3,2-g]chromen-7-one | CHEMBL164660 | Furo[...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars | PubMed | 600 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
F. Hoffmann-La Roche Ltd. Curated by ChEMBL | Assay Description Mechanism based inhibition of human cytochrome P450 2A6 measured by coumarin 7-hydroxylation | Curr Drug Metab 6: 413-54 (2005) BindingDB Entry DOI: 10.7270/Q2VQ33X3 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Beta-secretase 1 (Homo sapiens (Human)) | BDBM50331544 (7H-furo[3,2-g]chromen-7-one | CHEMBL164660 | Furo[...) | PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet | Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | >5.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Kinki University Curated by ChEMBL | Assay Description Inhibition of recombinant human BACE1 using Rh-EVNLDAEFK as substrate after 60 mins by fluorescence quenching assay | Bioorg Med Chem 20: 784-8 (2012) Article DOI: 10.1016/j.bmc.2011.12.002 BindingDB Entry DOI: 10.7270/Q2F47PKK | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Nuclear factor NF-kappa-B p105 subunit (Homo sapiens (Human)) | BDBM50331544 (7H-furo[3,2-g]chromen-7-one | CHEMBL164660 | Furo[...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
BioPharmaNet Curated by ChEMBL | Assay Description Inhibition of NF-KB p50 subunit/DNA interaction after 20 mins by EMSA | Bioorg Med Chem 18: 8341-9 (2010) Article DOI: 10.1016/j.bmc.2010.09.063 BindingDB Entry DOI: 10.7270/Q27W6CFD | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Amine oxidase [flavin-containing] A (Homo sapiens (Human)) | BDBM50331544 (7H-furo[3,2-g]chromen-7-one | CHEMBL164660 | Furo[...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet | Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | >2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunchon National University Curated by ChEMBL | Assay Description Inhibition of human recombinant MAO-A expressed in baculovirus infected BTI insect cells using kynuramine as substrate after 20 mins by spectrophotom... | Bioorg Med Chem Lett 29: 839-843 (2019) Article DOI: 10.1016/j.bmcl.2019.01.016 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Acetylcholinesterase (Homo sapiens (Human)) | BDBM50331544 (7H-furo[3,2-g]chromen-7-one | CHEMBL164660 | Furo[...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 6.48E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Monastir Curated by ChEMBL | Assay Description Inhibition of acetylcholinesterase (unknown origin) using acetylcholine iodide as substrate preincubated for 15 mins prior to substrate addition by s... | Bioorg Med Chem Lett 23: 4248-52 (2013) Article DOI: 10.1016/j.bmcl.2013.04.081 BindingDB Entry DOI: 10.7270/Q29W0JCX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Acetylcholinesterase (Electrophorus electricus (Electric eel)) | BDBM50331544 (7H-furo[3,2-g]chromen-7-one | CHEMBL164660 | Furo[...) | UniProtKB/SwissProt GoogleScholar AffyNet | Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 2.95E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunchon National University Curated by ChEMBL | Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 15 mins followed by substrate addition by Ellman's metho... | Bioorg Med Chem Lett 29: 839-843 (2019) Article DOI: 10.1016/j.bmcl.2019.01.016 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Amine oxidase [flavin-containing] B (Homo sapiens (Human)) | BDBM50331544 (7H-furo[3,2-g]chromen-7-one | CHEMBL164660 | Furo[...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | >6.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Sunchon National University Curated by ChEMBL | Assay Description Inhibition of human recombinant MAO-B expressed in baculovirus infected BTI insect cells using benzylamine as substrate after 30 mins by spectrophoto... | Bioorg Med Chem Lett 29: 839-843 (2019) Article DOI: 10.1016/j.bmcl.2019.01.016 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Replicase polyprotein 1a (Human SARS coronavirus (SARS-CoV)) | BDBM50331544 (7H-furo[3,2-g]chromen-7-one | CHEMBL164660 | Furo[...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet | Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | >1.50E+5 | n/a | n/a | n/a | n/a | 8.0 | n/a |
Gyeongsang National University | Assay Description Reactions were performed in a total volume of 200 mL, which contained thefollowing components: 20mM Tris-buffer, pH 8.0, 10mM DTT, 30 mM Z-RLRGG-AMC,... | J Enzyme Inhib Med Chem 29: 59-63 (2014) Article DOI: 10.3109/14756366.2012.753591 BindingDB Entry DOI: 10.7270/Q21835FQ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Amine oxidase [flavin-containing] A (Homo sapiens (Human)) | BDBM50331544 (7H-furo[3,2-g]chromen-7-one | CHEMBL164660 | Furo[...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet | Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 2.13E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
R.C. Patel Institute of Pharmaceutical Education and Research Curated by ChEMBL | Assay Description Inhibition of MAO-A (unknown origin) | Bioorg Med Chem 21: 2434-50 (2013) Article DOI: 10.1016/j.bmc.2013.02.017 BindingDB Entry DOI: 10.7270/Q25T3PCS | |||||||||||
More data for this Ligand-Target Pair |