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Compile Data Set for Download or QSAR

Found 4 hits of ic50 for monomerid = 50334339   
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
Caspase-9


(Homo sapiens (Human))
BDBM50334339
PNG
(CHEMBL1358008 | N-Benzyl-6-(1-(dimethylamino)butan...)
Show SMILES CCC(CN(C)C)Oc1cc(NCc2ccccc2)c2ncn(C(C)C)c2c1
Show InChI InChI=1S/C23H32N4O/c1-6-19(15-26(4)5)28-20-12-21(24-14-18-10-8-7-9-11-18)23-22(13-20)27(16-25-23)17(2)3/h7-13,16-17,19,24H,6,14-15H2,1-5H3
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PCBioAssay
n/an/a 3.74E+3n/an/an/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 (SBIMR, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q25M647F
More data for this
Ligand-Target Pair
Apoptotic protease-activating factor 1


(Homo sapiens (Human))
BDBM50334339
PNG
(CHEMBL1358008 | N-Benzyl-6-(1-(dimethylamino)butan...)
Show SMILES CCC(CN(C)C)Oc1cc(NCc2ccccc2)c2ncn(C(C)C)c2c1
Show InChI InChI=1S/C23H32N4O/c1-6-19(15-26(4)5)28-20-12-21(24-14-18-10-8-7-9-11-18)23-22(13-20)27(16-25-23)17(2)3/h7-13,16-17,19,24H,6,14-15H2,1-5H3
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n/an/a 7.98E+3n/an/an/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 (SBIMR, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2JS9NZB
More data for this
Ligand-Target Pair
Apoptotic protease-activating factor 1


(Homo sapiens (Human))
BDBM50334339
PNG
(CHEMBL1358008 | N-Benzyl-6-(1-(dimethylamino)butan...)
Show SMILES CCC(CN(C)C)Oc1cc(NCc2ccccc2)c2ncn(C(C)C)c2c1
Show InChI InChI=1S/C23H32N4O/c1-6-19(15-26(4)5)28-20-12-21(24-14-18-10-8-7-9-11-18)23-22(13-20)27(16-25-23)17(2)3/h7-13,16-17,19,24H,6,14-15H2,1-5H3
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n/an/a>1.00E+5n/an/an/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 (SBIMR, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2F18X8S
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 5 activator 1


(Homo sapiens (Human))
BDBM50334339
PNG
(CHEMBL1358008 | N-Benzyl-6-(1-(dimethylamino)butan...)
Show SMILES CCC(CN(C)C)Oc1cc(NCc2ccccc2)c2ncn(C(C)C)c2c1
Show InChI InChI=1S/C23H32N4O/c1-6-19(15-26(4)5)28-20-12-21(24-14-18-10-8-7-9-11-18)23-22(13-20)27(16-25-23)17(2)3/h7-13,16-17,19,24H,6,14-15H2,1-5H3
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Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of CDK5/P25 GST-fusion protein assessed as substrate histone H1 phosphorylation by scintillation counting


Bioorg Med Chem 19: 359-73 (2011)


Article DOI: 10.1016/j.bmc.2010.11.022
BindingDB Entry DOI: 10.7270/Q21G0MJC
More data for this
Ligand-Target Pair