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Compile Data Set for Download or QSAR

Found 7 hits of ki for UniProtKB: P19835   
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
Bile salt-activated lipase


(Homo sapiens (Human))
BDBM50081700
PNG
(6-Chloro-3-(2-cyclohexyl-ethyl)-pyran-2-one | CHEM...)
Show SMILES Clc1ccc(CCC2CCCCC2)c(=O)o1
Show InChI InChI=1S/C13H17ClO2/c14-12-9-8-11(13(15)16-12)7-6-10-4-2-1-3-5-10/h8-10H,1-7H2
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25n/an/an/an/an/an/an/an/a



University of New Mexico

Curated by ChEMBL


Assay Description
Inhibition of the Pancreatic Cholesterol Esterase from porcine


J Med Chem 42: 4250-6 (1999)


BindingDB Entry DOI: 10.7270/Q2KP81C5
More data for this
Ligand-Target Pair
Bile salt-activated lipase


(Homo sapiens (Human))
BDBM50081696
PNG
(6-Chloro-3-cyclopentyl-pyran-2-one | CHEMBL133091)
Show SMILES Clc1ccc(C2CCCC2)c(=O)o1
Show InChI InChI=1S/C10H11ClO2/c11-9-6-5-8(10(12)13-9)7-3-1-2-4-7/h5-7H,1-4H2
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40n/an/an/an/an/an/an/an/a



University of New Mexico

Curated by ChEMBL


Assay Description
Inhibition of the Pancreatic Cholesterol Esterase from porcine


J Med Chem 42: 4250-6 (1999)


BindingDB Entry DOI: 10.7270/Q2KP81C5
More data for this
Ligand-Target Pair
Bile salt-activated lipase


(Homo sapiens (Human))
BDBM50081698
PNG
(6-Chloro-5-(2-cyclohexyl-ethyl)-pyran-2-one | CHEM...)
Show SMILES Clc1oc(=O)ccc1CCC1CCCCC1
Show InChI InChI=1S/C13H17ClO2/c14-13-11(8-9-12(15)16-13)7-6-10-4-2-1-3-5-10/h8-10H,1-7H2
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58n/an/an/an/an/an/an/an/a



University of New Mexico

Curated by ChEMBL


Assay Description
Inhibition of the Pancreatic Cholesterol Esterase from porcine


J Med Chem 42: 4250-6 (1999)


BindingDB Entry DOI: 10.7270/Q2KP81C5
More data for this
Ligand-Target Pair
Bile salt-activated lipase


(Homo sapiens (Human))
BDBM50081697
PNG
(6-Chloro-3-(3-cyclohexyl-propyl)-pyran-2-one | CHE...)
Show SMILES Clc1ccc(CCCC2CCCCC2)c(=O)o1
Show InChI InChI=1S/C14H19ClO2/c15-13-10-9-12(14(16)17-13)8-4-7-11-5-2-1-3-6-11/h9-11H,1-8H2
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60n/an/an/an/an/an/an/an/a



University of New Mexico

Curated by ChEMBL


Assay Description
Inhibition of the Pancreatic Cholesterol Esterase from porcine


J Med Chem 42: 4250-6 (1999)


BindingDB Entry DOI: 10.7270/Q2KP81C5
More data for this
Ligand-Target Pair
Bile salt-activated lipase


(Homo sapiens (Human))
BDBM50081695
PNG
(6-Chloro-3-(4-cyclohexyl-butyl)-pyran-2-one | CHEM...)
Show SMILES Clc1ccc(CCCCC2CCCCC2)c(=O)o1
Show InChI InChI=1S/C15H21ClO2/c16-14-11-10-13(15(17)18-14)9-5-4-8-12-6-2-1-3-7-12/h10-12H,1-9H2
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580n/an/an/an/an/an/an/an/a



University of New Mexico

Curated by ChEMBL


Assay Description
Inhibition of the Pancreatic Cholesterol Esterase from porcine


J Med Chem 42: 4250-6 (1999)


BindingDB Entry DOI: 10.7270/Q2KP81C5
More data for this
Ligand-Target Pair
Bile salt-activated lipase


(Homo sapiens (Human))
BDBM50081694
PNG
(6-Chloro-3-cyclohexylmethyl-pyran-2-one | CHEMBL44...)
Show SMILES Clc1ccc(CC2CCCCC2)c(=O)o1
Show InChI InChI=1S/C12H15ClO2/c13-11-7-6-10(12(14)15-11)8-9-4-2-1-3-5-9/h6-7,9H,1-5,8H2
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2.20E+3n/an/an/an/an/an/an/an/a



University of New Mexico

Curated by ChEMBL


Assay Description
Inhibition of the Pancreatic Cholesterol Esterase from porcine


J Med Chem 42: 4250-6 (1999)


BindingDB Entry DOI: 10.7270/Q2KP81C5
More data for this
Ligand-Target Pair
Bile salt-activated lipase


(Homo sapiens (Human))
BDBM50081699
PNG
(6-Chloro-3-cyclohexyl-pyran-2-one | CHEMBL134790)
Show SMILES Clc1ccc(C2CCCCC2)c(=O)o1
Show InChI InChI=1S/C11H13ClO2/c12-10-7-6-9(11(13)14-10)8-4-2-1-3-5-8/h6-8H,1-5H2
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2.30E+3n/an/an/an/an/an/an/an/a



University of New Mexico

Curated by ChEMBL


Assay Description
Inhibition of the Pancreatic Cholesterol Esterase from porcine


J Med Chem 42: 4250-6 (1999)


BindingDB Entry DOI: 10.7270/Q2KP81C5
More data for this
Ligand-Target Pair