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SMILES: Cc1cc(Br)ccc1NC(=O)CN1C(=O)CCC1=O

InChI Key: InChIKey=RZSXNVKVRDVWKN-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 2 hits for monomerid = 68824   
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
Nuclear receptor subfamily 5 group A member 2


(Homo sapiens (Human))
BDBM68824
PNG
(2-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]-N-(4-bro...)
Show SMILES Cc1cc(Br)ccc1NC(=O)CN1C(=O)CCC1=O
Show InChI InChI=1S/C13H13BrN2O3/c1-8-6-9(14)2-3-10(8)15-11(17)7-16-12(18)4-5-13(16)19/h2-3,6H,4-5,7H2,1H3,(H,15,17)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>1.20E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q22F7M18
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3 beta


(Homo sapiens (Human))
BDBM68824
PNG
(2-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]-N-(4-bro...)
Show SMILES Cc1cc(Br)ccc1NC(=O)CN1C(=O)CCC1=O
Show InChI InChI=1S/C13H13BrN2O3/c1-8-6-9(14)2-3-10(8)15-11(17)7-16-12(18)4-5-13(16)19/h2-3,6H,4-5,7H2,1H3,(H,15,17)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a>3.00E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: GSK3beta, dose response, kinase, inhibition, HTS Assay Overview: The glycogen synthase kinase-3 beta (GSK-3b) is a known master regulator f...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2TX3CTT
More data for this
Ligand-Target Pair