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SMILES: C(CN1CCOCC1)Nc1nc(Nc2ccccc2)nc(Nc2ccccc2)n1

InChI Key: InChIKey=ZHTRWWCLHQXSRF-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 = 50178993   
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
Replicative DNA helicase


(Pseudomonas aeruginosa)
BDBM50178993
PNG
(CHEMBL204595 | N-(2-morpholinoethyl)-N',N''-diphen...)
Show SMILES C(CN1CCOCC1)Nc1nc(Nc2ccccc2)nc(Nc2ccccc2)n1
Show InChI InChI=1S/C21H25N7O/c1-3-7-17(8-4-1)23-20-25-19(22-11-12-28-13-15-29-16-14-28)26-21(27-20)24-18-9-5-2-6-10-18/h1-10H,11-16H2,(H3,22,23,24,25,26,27)
KEGG

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Targanta Therapeutics Inc.

Curated by ChEMBL


Assay Description
Inhibition of Pseudomonas aeruginosa DnaB helicase


Bioorg Med Chem Lett 16: 1286-90 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.076
BindingDB Entry DOI: 10.7270/Q2PG1R95
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3 beta


(Homo sapiens (Human))
BDBM50178993
PNG
(CHEMBL204595 | N-(2-morpholinoethyl)-N',N''-diphen...)
Show SMILES C(CN1CCOCC1)Nc1nc(Nc2ccccc2)nc(Nc2ccccc2)n1
Show InChI InChI=1S/C21H25N7O/c1-3-7-17(8-4-1)23-20-25-19(22-11-12-28-13-15-29-16-14-28)26-21(27-20)24-18-9-5-2-6-10-18/h1-10H,11-16H2,(H3,22,23,24,25,26,27)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
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