BDBM50157562 1,3-bis(3,4-dihydroxyphenyl)prop-2-en-1-one::3,3',4,4'-tetrahydroxychalcone::CHEMBL225618::US9085549, 94
SMILES: Oc1ccc(\C=C\C(=O)c2ccc(O)c(O)c2)cc1O
InChI Key: InChIKey=DOWSJIIZLUFMFM-DAFODLJHSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Alpha-synuclein (Homo sapiens (Human)) | BDBM50157562 (1,3-bis(3,4-dihydroxyphenyl)prop-2-en-1-one | 3,3'...) | PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | US Patent | 1.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a | 7.4 | n/a |
PROTEOTECH INC US Patent | Assay Description The compounds prepared in the preceding examples were found to bind with high affinity to α-synuclein aggregates/fibrils that are found in the h... | US Patent US9085549 (2015) BindingDB Entry DOI: 10.7270/Q2WD3Z9K | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Telomerase reverse transcriptase (Homo sapiens (Human)) | BDBM50157562 (1,3-bis(3,4-dihydroxyphenyl)prop-2-en-1-one | 3,3'...) | PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 1.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
BU-Nerviano Medical Sciences Curated by ChEMBL | Assay Description Inhibition of human telomerase from HEK293 cell extracts by Flash-Plate assay | J Med Chem 47: 6466-75 (2004) Article DOI: 10.1021/jm040810b BindingDB Entry DOI: 10.7270/Q2P55N1R | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Xanthine dehydrogenase (Bos taurus (Bovine)) | BDBM50157562 (1,3-bis(3,4-dihydroxyphenyl)prop-2-en-1-one | 3,3'...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | n/a | n/a | 3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Northern Kentucky University Curated by ChEMBL | Assay Description Inhibition of bovine xanthine oxidase assessed as conversion of xanthine to uric acid by spectroscopic analysis | Bioorg Med Chem 24: 578-87 (2016) BindingDB Entry DOI: 10.7270/Q23F4RJT | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Tau (Homo sapiens (Human)) | BDBM50157562 (1,3-bis(3,4-dihydroxyphenyl)prop-2-en-1-one | 3,3'...) | PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | US Patent | n/a | n/a | 2.14E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
PROTEOTECH INC US Patent | Assay Description The Thio S fluorometry assay as a primary screening method to identify tau protein aggregation inhibitors from our small molecule library. Aggregated... | US Patent US9085549 (2015) BindingDB Entry DOI: 10.7270/Q2WD3Z9K | |||||||||||
More data for this Ligand-Target Pair |