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Compile Data Set for Download or QSAR

Found 7 hits of ec50 data for polymerid = 129   
Target
(Institution)
LigandTarget
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-2


(Homo sapiens (human))
BDBM79403
PNG
(3-aminopropyl-[4-(3-aminopropylamino)butyl]amine;h...)
Show SMILES NCCCNCCCCNCCCN
Show InChI InChI=1S/C10H26N4/c11-5-3-9-13-7-1-2-8-14-10-4-6-12/h13-14H,1-12H2
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n/an/an/an/a 8.50E+3n/an/an/an/a



University of Illinois

Curated by ChEMBL


Assay Description
Activation of procaspase 2 after 24 hrs


Citation and Details
More data for this
Ligand-Target Pair
Caspase-2


(Homo sapiens (human))
BDBM80992
PNG
(1-cetylpyridin-1-ium;bromide | 1-hexadecylpyridin-...)
Show SMILES CCCCCCCCCCCCCCCC[n+]1ccccc1
Show InChI InChI=1S/C21H38N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19-22-20-17-15-18-21-22/h15,17-18,20-21H,2-14,16,19H2,1H3/q+1
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n/an/an/an/a 2.10E+4n/an/an/an/a



University of Illinois

Curated by ChEMBL


Assay Description
Activation of procaspase 2 after 24 hrs


Citation and Details
More data for this
Ligand-Target Pair
Caspase-2


(Homo sapiens (human))
BDBM50376459
PNG
(CHEMBL409053)
Show SMILES CN(C)CCNC(=O)COc1ccc(cc1)C12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C22H32N2O2/c1-24(2)8-7-23-21(25)15-26-20-5-3-19(4-6-20)22-12-16-9-17(13-22)11-18(10-16)14-22/h3-6,16-18H,7-15H2,1-2H3,(H,23,25)
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n/an/an/an/a 2.50E+4n/an/an/an/a



University of Illinois

Curated by ChEMBL


Assay Description
Activation of procaspase 2 after 24 hrs


Citation and Details
More data for this
Ligand-Target Pair
Caspase-2


(Homo sapiens (human))
BDBM50376460
PNG
(CHEMBL411858)
Show SMILES CC1CCCN(CC(O)COc2ccc(cc2)C23CC4CC(CC(C4)C2)C3)C1
Show InChI InChI=1S/C25H37NO2/c1-18-3-2-8-26(15-18)16-23(27)17-28-24-6-4-22(5-7-24)25-12-19-9-20(13-25)11-21(10-19)14-25/h4-7,18-21,23,27H,2-3,8-17H2,1H3
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n/an/an/an/a 2.50E+4n/an/an/an/a



University of Illinois

Curated by ChEMBL


Assay Description
Activation of procaspase 2 after 24 hrs


Citation and Details
More data for this
Ligand-Target Pair
Caspase-2


(Homo sapiens (human))
BDBM50376461
PNG
(CHEMBL262596)
Show SMILES Cc1cc(NNC(=O)C(c2ccccc2)c2ccccc2)c2ccc(C)c(C)c2n1
Show InChI InChI=1S/C26H25N3O/c1-17-14-15-22-23(16-18(2)27-25(22)19(17)3)28-29-26(30)24(20-10-6-4-7-11-20)21-12-8-5-9-13-21/h4-16,24H,1-3H3,(H,27,28)(H,29,30)
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n/an/an/an/a 5.00E+4n/an/an/an/a



University of Illinois

Curated by ChEMBL


Assay Description
Activation of procaspase 2 after 24 hrs


Citation and Details
More data for this
Ligand-Target Pair
Caspase-2


(Homo sapiens (human))
BDBM50376458
PNG
(CHEMBL259148)
Show SMILES NCCCNCCNCCCN
Show InChI InChI=1S/C8H22N4/c9-3-1-5-11-7-8-12-6-2-4-10/h11-12H,1-10H2
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n/an/an/an/a 5.00E+4n/an/an/an/a



University of Illinois

Curated by ChEMBL


Assay Description
Activation of procaspase 2 after 24 hrs


Citation and Details
More data for this
Ligand-Target Pair
Caspase-2


(Homo sapiens (human))
BDBM50376462
PNG
(CHEMBL265439)
Show SMILES CCCCCCCCCCNC(=O)CCC
Show InChI InChI=1S/C14H29NO/c1-3-5-6-7-8-9-10-11-13-15-14(16)12-4-2/h3-13H2,1-2H3,(H,15,16)
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n/an/an/an/a 6.60E+4n/an/an/an/a



University of Illinois

Curated by ChEMBL


Assay Description
Activation of procaspase 2 after 24 hrs


Citation and Details
More data for this
Ligand-Target Pair