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BDBM50316629 1,2,3-trimethoxy-7-(3,4,5-trimethoxyphenyl)naphthalene::CHEMBL1094498::cid_298141

SMILES: COc1cc(cc(OC)c1OC)-c1ccc2cc(OC)c(OC)c(OC)c2c1

InChI Key: InChIKey=HGKHSTXOENHPFT-UHFFFAOYSA-N

Data: 3 IC50  1 EC50

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 = 50316629   
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
corticotropin releasing factor-binding protein


(Homo sapiens (Human))
BDBM50316629
PNG
(1,2,3-trimethoxy-7-(3,4,5-trimethoxyphenyl)naphtha...)
Show SMILES COc1cc(cc(OC)c1OC)-c1ccc2cc(OC)c(OC)c(OC)c2c1
Show InChI InChI=1S/C22H24O6/c1-23-17-11-15(12-18(24-2)21(17)27-5)13-7-8-14-10-19(25-3)22(28-6)20(26-4)16(14)9-13/h7-12H,1-6H3
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a>5.30E+4n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2VX0F3D
More data for this
Ligand-Target Pair
N1L


(Vaccinia virus)
BDBM50316629
PNG
(1,2,3-trimethoxy-7-(3,4,5-trimethoxyphenyl)naphtha...)
Show SMILES COc1cc(cc(OC)c1OC)-c1ccc2cc(OC)c(OC)c(OC)c2c1
Show InChI InChI=1S/C22H24O6/c1-23-17-11-15(12-18(24-2)21(17)27-5)13-7-8-14-10-19(25-3)22(28-6)20(26-4)16(14)9-13/h7-12H,1-6H3
PDB
MMDB

KEGG

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 900n/an/an/an/an/an/a



Institute for Medical Research

Curated by ChEMBL


Assay Description
Displacement of FITC-conjugated BH3-Bak peptide from Vaccinia virus recombinant N1L expressed in Escherichia coli BL21 (DE3) by fluorescence polariza...


J Med Chem 53: 3899-906 (2010)


Article DOI: 10.1021/jm901446n
BindingDB Entry DOI: 10.7270/Q2NZ87SD
More data for this
Ligand-Target Pair
N1L


(Vaccinia virus)
BDBM50316629
PNG
(1,2,3-trimethoxy-7-(3,4,5-trimethoxyphenyl)naphtha...)
Show SMILES COc1cc(cc(OC)c1OC)-c1ccc2cc(OC)c(OC)c(OC)c2c1
Show InChI InChI=1S/C22H24O6/c1-23-17-11-15(12-18(24-2)21(17)27-5)13-7-8-14-10-19(25-3)22(28-6)20(26-4)16(14)9-13/h7-12H,1-6H3
PDB
MMDB

KEGG

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 900n/an/an/an/an/an/a



Institute for Medical Research

Curated by ChEMBL


Assay Description
Displacement of FITC-conjugated BH3-Bak peptide from 0.5 uM Vaccinia virus recombinant N1L expressed in Escherichia coli BL21 (DE3) by fluorescence p...


J Med Chem 53: 3899-906 (2010)


Article DOI: 10.1021/jm901446n
BindingDB Entry DOI: 10.7270/Q2NZ87SD
More data for this
Ligand-Target Pair
N1L


(Vaccinia virus)
BDBM50316629
PNG
(1,2,3-trimethoxy-7-(3,4,5-trimethoxyphenyl)naphtha...)
Show SMILES COc1cc(cc(OC)c1OC)-c1ccc2cc(OC)c(OC)c(OC)c2c1
Show InChI InChI=1S/C22H24O6/c1-23-17-11-15(12-18(24-2)21(17)27-5)13-7-8-14-10-19(25-3)22(28-6)20(26-4)16(14)9-13/h7-12H,1-6H3
PDB
MMDB

KEGG

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.60E+3n/an/an/an/an/an/a



Institute for Medical Research

Curated by ChEMBL


Assay Description
Displacement of FITC-conjugated BH3-Bak peptide from 1 uM Vaccinia virus recombinant N1L expressed in Escherichia coli BL21 (DE3) by fluorescence pol...


J Med Chem 53: 3899-906 (2010)


Article DOI: 10.1021/jm901446n
BindingDB Entry DOI: 10.7270/Q2NZ87SD
More data for this
Ligand-Target Pair