BindingDB logo
myBDB logout

BDBM50166896 4-Benzyl-3-(4-chloro-phenyl)-7-hydroxy-chromen-2-one::CHEMBL193518

SMILES: Oc1ccc2c(Cc3ccccc3)c(-c3ccc(Cl)cc3)c(=O)oc2c1

InChI Key: InChIKey=DNLRVCHWGNMSCA-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50166896   
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
Estradiol receptor beta (ERβ)


(Homo sapiens (Human))
BDBM50166896
PNG
(4-Benzyl-3-(4-chloro-phenyl)-7-hydroxy-chromen-2-o...)
Show SMILES Oc1ccc2c(Cc3ccccc3)c(-c3ccc(Cl)cc3)c(=O)oc2c1
Show InChI InChI=1S/C22H15ClO3/c23-16-8-6-15(7-9-16)21-19(12-14-4-2-1-3-5-14)18-11-10-17(24)13-20(18)26-22(21)25/h1-11,13,24H,12H2
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 250n/an/an/an/an/an/a



University of Southern California

Curated by ChEMBL


Assay Description
Binding affinity for human Estrogen receptor beta


J Med Chem 48: 3463-6 (2005)


Article DOI: 10.1021/jm0490538
BindingDB Entry DOI: 10.7270/Q2WS8V00
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM50166896
PNG
(4-Benzyl-3-(4-chloro-phenyl)-7-hydroxy-chromen-2-o...)
Show SMILES Oc1ccc2c(Cc3ccccc3)c(-c3ccc(Cl)cc3)c(=O)oc2c1
Show InChI InChI=1S/C22H15ClO3/c23-16-8-6-15(7-9-16)21-19(12-14-4-2-1-3-5-14)18-11-10-17(24)13-20(18)26-22(21)25/h1-11,13,24H,12H2
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 120n/an/an/an/an/an/a



University of Southern California

Curated by ChEMBL


Assay Description
Binding affinity for human Estrogen receptor Alpha


J Med Chem 48: 3463-6 (2005)


Article DOI: 10.1021/jm0490538
BindingDB Entry DOI: 10.7270/Q2WS8V00
More data for this
Ligand-Target Pair
Estradiol receptor beta (ERβ)


(Homo sapiens (Human))
BDBM50166896
PNG
(4-Benzyl-3-(4-chloro-phenyl)-7-hydroxy-chromen-2-o...)
Show SMILES Oc1ccc2c(Cc3ccccc3)c(-c3ccc(Cl)cc3)c(=O)oc2c1
Show InChI InChI=1S/C22H15ClO3/c23-16-8-6-15(7-9-16)21-19(12-14-4-2-1-3-5-14)18-11-10-17(24)13-20(18)26-22(21)25/h1-11,13,24H,12H2
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 250n/an/an/an/an/an/a



University of Southern California

Curated by ChEMBL


Assay Description
Binding affinity for human Estrogen receptor beta


J Med Chem 48: 3463-6 (2005)


Article DOI: 10.1021/jm0490538
BindingDB Entry DOI: 10.7270/Q2WS8V00
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM50166896
PNG
(4-Benzyl-3-(4-chloro-phenyl)-7-hydroxy-chromen-2-o...)
Show SMILES Oc1ccc2c(Cc3ccccc3)c(-c3ccc(Cl)cc3)c(=O)oc2c1
Show InChI InChI=1S/C22H15ClO3/c23-16-8-6-15(7-9-16)21-19(12-14-4-2-1-3-5-14)18-11-10-17(24)13-20(18)26-22(21)25/h1-11,13,24H,12H2
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 120n/an/an/an/an/an/a



University of Southern California

Curated by ChEMBL


Assay Description
Binding affinity for human Estrogen receptor Alpha


J Med Chem 48: 3463-6 (2005)


Article DOI: 10.1021/jm0490538
BindingDB Entry DOI: 10.7270/Q2WS8V00
More data for this
Ligand-Target Pair