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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Pro-glucagon' and Ligand = 'BDBM100823'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Pro-glucagon


(Homo sapiens (Human))
BDBM100823
PNG
(US8507533, 130 | US8507533, 369)
Show SMILES CCCC(Oc1cc(C)c(c(C)c1)-n1cc(Cl)cn1)c1ccc(cc1)C(=O)NCCC(O)=O
Show InChI InChI=1S/C25H28ClN3O4/c1-4-5-22(18-6-8-19(9-7-18)25(32)27-11-10-23(30)31)33-21-12-16(2)24(17(3)13-21)29-15-20(26)14-28-29/h6-9,12-15,22H,4-5,10-11H2,1-3H3,(H,27,32)(H,30,31)
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PC cid
PC sid
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Similars

US Patent
93.2n/an/an/an/an/an/a7.4n/a



Pfizer Inc.

US Patent


Assay Description
The Glucagon SPA assay is used to determine the ability of test compounds to block the binding of glucagon-cex to the glucagon receptors.


US Patent US8507533 (2013)


BindingDB Entry DOI: 10.7270/Q23R0RGH
More data for this
Ligand-Target Pair
Pro-glucagon


(Homo sapiens (Human))
BDBM100823
PNG
(US8507533, 130 | US8507533, 369)
Show SMILES CCCC(Oc1cc(C)c(c(C)c1)-n1cc(Cl)cn1)c1ccc(cc1)C(=O)NCCC(O)=O
Show InChI InChI=1S/C25H28ClN3O4/c1-4-5-22(18-6-8-19(9-7-18)25(32)27-11-10-23(30)31)33-21-12-16(2)24(17(3)13-21)29-15-20(26)14-28-29/h6-9,12-15,22H,4-5,10-11H2,1-3H3,(H,27,32)(H,30,31)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
116n/an/an/an/an/an/a7.4n/a



Pfizer Inc.

US Patent


Assay Description
The Glucagon SPA assay is used to determine the ability of test compounds to block the binding of glucagon-cex to the glucagon receptors.


US Patent US8507533 (2013)


BindingDB Entry DOI: 10.7270/Q23R0RGH
More data for this
Ligand-Target Pair