BindingDB logo
myBDB logout

null

SMILES: CCCOc1cccc(OCCC)c1-c1cc([nH]c1-c1ccncc1)-c1ccc(Cl)cc1

InChI Key: InChIKey=RYGNZEQECYUPSL-UHFFFAOYSA-N

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 = 50075763   
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
Glucagon receptor


(Mus musculus)
BDBM50075763
PNG
(4-[5-(4-Chloro-phenyl)-3-(2,6-dipropoxy-phenyl)-1H...)
Show SMILES CCCOc1cccc(OCCC)c1-c1cc([nH]c1-c1ccncc1)-c1ccc(Cl)cc1 |(9.36,4.01,;8.87,2.56,;7.36,2.26,;6.87,.79,;5.46,.18,;4.21,1.09,;2.81,.46,;2.64,-1.08,;3.88,-1.98,;3.72,-3.51,;2.32,-4.14,;1.07,-3.23,;-.34,-3.85,;5.28,-1.36,;6.53,-2.27,;7.99,-1.8,;8.9,-3.04,;7.99,-4.29,;6.52,-3.81,;5.27,-4.7,;3.93,-3.93,;2.6,-4.7,;2.6,-6.24,;3.95,-7.01,;5.27,-6.24,;10.43,-3.06,;11.18,-4.39,;12.72,-4.39,;13.51,-3.06,;15.05,-3.06,;12.74,-1.73,;11.2,-1.73,)|
Show InChI InChI=1S/C27H27ClN2O2/c1-3-16-31-24-6-5-7-25(32-17-4-2)26(24)22-18-23(19-8-10-21(28)11-9-19)30-27(22)20-12-14-29-15-13-20/h5-15,18,30H,3-4,16-17H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a>3.00E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards glucagon receptor determined by reduction in binding of 125 I-glucagon to the murine glucagon receptor (mGLUR) expressed on ...


Bioorg Med Chem Lett 9: 641-6 (1999)


BindingDB Entry DOI: 10.7270/Q2VD6XM1
More data for this
Ligand-Target Pair
Glucagon receptor


(Homo sapiens (Human))
BDBM50075763
PNG
(4-[5-(4-Chloro-phenyl)-3-(2,6-dipropoxy-phenyl)-1H...)
Show SMILES CCCOc1cccc(OCCC)c1-c1cc([nH]c1-c1ccncc1)-c1ccc(Cl)cc1 |(9.36,4.01,;8.87,2.56,;7.36,2.26,;6.87,.79,;5.46,.18,;4.21,1.09,;2.81,.46,;2.64,-1.08,;3.88,-1.98,;3.72,-3.51,;2.32,-4.14,;1.07,-3.23,;-.34,-3.85,;5.28,-1.36,;6.53,-2.27,;7.99,-1.8,;8.9,-3.04,;7.99,-4.29,;6.52,-3.81,;5.27,-4.7,;3.93,-3.93,;2.6,-4.7,;2.6,-6.24,;3.95,-7.01,;5.27,-6.24,;10.43,-3.06,;11.18,-4.39,;12.72,-4.39,;13.51,-3.06,;15.05,-3.06,;12.74,-1.73,;11.2,-1.73,)|
Show InChI InChI=1S/C27H27ClN2O2/c1-3-16-31-24-6-5-7-25(32-17-4-2)26(24)22-18-23(19-8-10-21(28)11-9-19)30-27(22)20-12-14-29-15-13-20/h5-15,18,30H,3-4,16-17H2,1-2H3
PDB
MMDB

UniProtKB/SwissProt

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

Similars

PubMed
n/an/a 290n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards glucagon receptor determined by reduction in binding of [125I]-glucagon to the human glucagon receptor (GGR) expressed on CH...


Bioorg Med Chem Lett 9: 641-6 (1999)


BindingDB Entry DOI: 10.7270/Q2VD6XM1
More data for this
Ligand-Target Pair
Glucagon receptor


(Mus musculus)
BDBM50075763
PNG
(4-[5-(4-Chloro-phenyl)-3-(2,6-dipropoxy-phenyl)-1H...)
Show SMILES CCCOc1cccc(OCCC)c1-c1cc([nH]c1-c1ccncc1)-c1ccc(Cl)cc1 |(9.36,4.01,;8.87,2.56,;7.36,2.26,;6.87,.79,;5.46,.18,;4.21,1.09,;2.81,.46,;2.64,-1.08,;3.88,-1.98,;3.72,-3.51,;2.32,-4.14,;1.07,-3.23,;-.34,-3.85,;5.28,-1.36,;6.53,-2.27,;7.99,-1.8,;8.9,-3.04,;7.99,-4.29,;6.52,-3.81,;5.27,-4.7,;3.93,-3.93,;2.6,-4.7,;2.6,-6.24,;3.95,-7.01,;5.27,-6.24,;10.43,-3.06,;11.18,-4.39,;12.72,-4.39,;13.51,-3.06,;15.05,-3.06,;12.74,-1.73,;11.2,-1.73,)|
Show InChI InChI=1S/C27H27ClN2O2/c1-3-16-31-24-6-5-7-25(32-17-4-2)26(24)22-18-23(19-8-10-21(28)11-9-19)30-27(22)20-12-14-29-15-13-20/h5-15,18,30H,3-4,16-17H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 670n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity determined by reduction in binding of 125 I-glucagon to the human glucagon receptor expressed on CHO cells in absence of Mg+2


Bioorg Med Chem Lett 9: 641-6 (1999)


BindingDB Entry DOI: 10.7270/Q2VD6XM1
More data for this
Ligand-Target Pair
Glucagon receptor


(Homo sapiens (Human))
BDBM50075763
PNG
(4-[5-(4-Chloro-phenyl)-3-(2,6-dipropoxy-phenyl)-1H...)
Show SMILES CCCOc1cccc(OCCC)c1-c1cc([nH]c1-c1ccncc1)-c1ccc(Cl)cc1 |(9.36,4.01,;8.87,2.56,;7.36,2.26,;6.87,.79,;5.46,.18,;4.21,1.09,;2.81,.46,;2.64,-1.08,;3.88,-1.98,;3.72,-3.51,;2.32,-4.14,;1.07,-3.23,;-.34,-3.85,;5.28,-1.36,;6.53,-2.27,;7.99,-1.8,;8.9,-3.04,;7.99,-4.29,;6.52,-3.81,;5.27,-4.7,;3.93,-3.93,;2.6,-4.7,;2.6,-6.24,;3.95,-7.01,;5.27,-6.24,;10.43,-3.06,;11.18,-4.39,;12.72,-4.39,;13.51,-3.06,;15.05,-3.06,;12.74,-1.73,;11.2,-1.73,)|
Show InChI InChI=1S/C27H27ClN2O2/c1-3-16-31-24-6-5-7-25(32-17-4-2)26(24)22-18-23(19-8-10-21(28)11-9-19)30-27(22)20-12-14-29-15-13-20/h5-15,18,30H,3-4,16-17H2,1-2H3
PDB
MMDB

UniProtKB/SwissProt

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

Similars

PubMed
n/an/a 40n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity determined by reduction in binding of 125 I-glucagon to the human glucagon receptor expressed on CHO cells in absence of Mg+2


Bioorg Med Chem Lett 9: 641-6 (1999)


BindingDB Entry DOI: 10.7270/Q2VD6XM1
More data for this
Ligand-Target Pair