BindingDB logo
myBDB logout

BDBM50335199 3-Acetyl-7-(4-hydroxyphenyl)-2H-chromen-2-one::CHEMBL1650702

SMILES: CC(=O)c1cc2ccc(cc2oc1=O)-c1ccc(O)cc1

InChI Key: InChIKey=ZQKQNWVNRGJPJK-UHFFFAOYSA-N

Data: 1 KI  1 IC50

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 = 50335199   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50335199
PNG
(3-Acetyl-7-(4-hydroxyphenyl)-2H-chromen-2-one | CH...)
Show SMILES CC(=O)c1cc2ccc(cc2oc1=O)-c1ccc(O)cc1
Show InChI InChI=1S/C17H12O4/c1-10(18)15-8-13-3-2-12(9-16(13)21-17(15)20)11-4-6-14(19)7-5-11/h2-9,19H,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
143n/an/an/an/an/an/an/an/a



University of Ljubljana

Curated by ChEMBL


Assay Description
Displacement of [3H]estrone human recombinant 17beta-HSD1 expressed in Escherichia coli BL21 (DE3)-RIL by competitive inhibition assay in presence of...


J Med Chem 54: 248-61 (2011)


Article DOI: 10.1021/jm101104z
BindingDB Entry DOI: 10.7270/Q2QV3NG1
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50335199
PNG
(3-Acetyl-7-(4-hydroxyphenyl)-2H-chromen-2-one | CH...)
Show SMILES CC(=O)c1cc2ccc(cc2oc1=O)-c1ccc(O)cc1
Show InChI InChI=1S/C17H12O4/c1-10(18)15-8-13-3-2-12(9-16(13)21-17(15)20)11-4-6-14(19)7-5-11/h2-9,19H,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 270n/an/an/an/an/an/a



University of Ljubljana

Curated by ChEMBL


Assay Description
Displacement of [3H]estrone human recombinant 17beta-HSD1 expressed in Escherichia coli BL21 (DE3)-RIL by scintillation counting in presence of bacte...


J Med Chem 54: 248-61 (2011)


Article DOI: 10.1021/jm101104z
BindingDB Entry DOI: 10.7270/Q2QV3NG1
More data for this
Ligand-Target Pair