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Compile Data Set for Download or QSAR

Found 6 hits of kd for UniProtKB: P04273   
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
Major prion protein


(Mesocricetus auratus)
BDBM50451080
PNG
(CHEMBL394400)
Show SMILES COc1ccc(cc1)-c1nc(N)sc1-c1ccc(OC)cc1
Show InChI InChI=1S/C17H16N2O2S/c1-20-13-7-3-11(4-8-13)15-16(22-17(18)19-15)12-5-9-14(21-2)10-6-12/h3-10H,1-2H3,(H2,18,19)
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n/an/an/a 1.55E+4n/an/an/an/an/a



University of Alberta

Curated by ChEMBL


Assay Description
Binding affinity to Syrian hamster PrPC


Bioorg Med Chem 25: 5875-5888 (2017)


Article DOI: 10.1016/j.bmc.2017.09.024
BindingDB Entry DOI: 10.7270/Q2QR50Q1
More data for this
Ligand-Target Pair
Major prion protein


(Mesocricetus auratus)
BDBM50451082
PNG
(CHEMBL4213201)
Show SMILES COc1ccc(OC)c(Nc2nnc(s2)-c2cc3cccc(OC)c3oc2=O)c1
Show InChI InChI=1S/C20H17N3O5S/c1-25-12-7-8-15(26-2)14(10-12)21-20-23-22-18(29-20)13-9-11-5-4-6-16(27-3)17(11)28-19(13)24/h4-10H,1-3H3,(H,21,23)
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n/an/an/a 4.64E+4n/an/an/an/an/a



University of Alberta

Curated by ChEMBL


Assay Description
Binding affinity to Syrian hamster PrPC


Bioorg Med Chem 25: 5875-5888 (2017)


Article DOI: 10.1016/j.bmc.2017.09.024
BindingDB Entry DOI: 10.7270/Q2QR50Q1
More data for this
Ligand-Target Pair
Major prion protein


(Mesocricetus auratus)
BDBM50451079
PNG
(CHEMBL4205700)
Show SMILES O=C(CC1CNc2ccccc12)NC1CCc2ccccc2C1
Show InChI InChI=1S/C20H22N2O/c23-20(12-16-13-21-19-8-4-3-7-18(16)19)22-17-10-9-14-5-1-2-6-15(14)11-17/h1-8,16-17,21H,9-13H2,(H,22,23)
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n/an/an/a 4.86E+4n/an/an/an/an/a



University of Alberta

Curated by ChEMBL


Assay Description
Binding affinity to Syrian hamster PrPC


Bioorg Med Chem 25: 5875-5888 (2017)


Article DOI: 10.1016/j.bmc.2017.09.024
BindingDB Entry DOI: 10.7270/Q2QR50Q1
More data for this
Ligand-Target Pair
Major prion protein


(Mesocricetus auratus)
BDBM50333113
PNG
(8-methyl-7-(2-(piperidin-1-yl)ethylthio)-2,3-dihyd...)
Show SMILES Cc1cc2cc3OCCOc3cc2nc1SCCN1CCCCC1
Show InChI InChI=1S/C19H24N2O2S/c1-14-11-15-12-17-18(23-9-8-22-17)13-16(15)20-19(14)24-10-7-21-5-3-2-4-6-21/h11-13H,2-10H2,1H3
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PC sid
UniChem
Article
PubMed
n/an/an/a 5.08E+4n/an/an/an/an/a



University of Alberta

Curated by ChEMBL


Assay Description
Binding affinity to Syrian hamster PrPC


Bioorg Med Chem 25: 5875-5888 (2017)


Article DOI: 10.1016/j.bmc.2017.09.024
BindingDB Entry DOI: 10.7270/Q2QR50Q1
More data for this
Ligand-Target Pair
Major prion protein


(Mesocricetus auratus)
BDBM50333110
PNG
(CHEMBL1631113 | N-(1-(indolin-1-yl)-3-methyl-1-oxo...)
Show SMILES CCC(C)C(NC(=O)c1ccccc1)C(=O)N1CCc2ccccc12
Show InChI InChI=1S/C21H24N2O2/c1-3-15(2)19(22-20(24)17-10-5-4-6-11-17)21(25)23-14-13-16-9-7-8-12-18(16)23/h4-12,15,19H,3,13-14H2,1-2H3,(H,22,24)
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Similars

Article
PubMed
n/an/an/a 5.12E+4n/an/an/an/an/a



University of Alberta

Curated by ChEMBL


Assay Description
Binding affinity to Syrian hamster PrPC


Bioorg Med Chem 25: 5875-5888 (2017)


Article DOI: 10.1016/j.bmc.2017.09.024
BindingDB Entry DOI: 10.7270/Q2QR50Q1
More data for this
Ligand-Target Pair
Major prion protein


(Mesocricetus auratus)
BDBM50451081
PNG
(CHEMBL4218961)
Show SMILES COc1ccc(OC)c(c1)-c1nc(NC(=O)c2cc(OC)c(OC)c(OC)c2)sc1C
Show InChI InChI=1S/C22H24N2O6S/c1-12-19(15-11-14(26-2)7-8-16(15)27-3)23-22(31-12)24-21(25)13-9-17(28-4)20(30-6)18(10-13)29-5/h7-11H,1-6H3,(H,23,24,25)
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n/an/an/a 1.85E+5n/an/an/an/an/a



University of Alberta

Curated by ChEMBL


Assay Description
Binding affinity to Syrian hamster PrPC


Bioorg Med Chem 25: 5875-5888 (2017)


Article DOI: 10.1016/j.bmc.2017.09.024
BindingDB Entry DOI: 10.7270/Q2QR50Q1
More data for this
Ligand-Target Pair