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PubMed code 25678014

Compile data set for download or QSAR
Found 20 hits of Enzyme Inhibition Constant Data   
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
Hormone-sensitive lipase


(Rattus norvegicus (Rat))		BDBM50064422
PNG
(CHEMBL3401162)
Show SMILES [H][C@@]12COC(=O)C1=C(C)O[P@](=O)(OCCCCCCCCCCCCCCCC)OC2 |r,t:7|
Show InChI InChI=1S/C23H41O6P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-27-30(25)28-19-21-18-26-23(24)22(21)20(2)29-30/h21H,3-19H2,1-2H3/t21-,30+/m0/s1
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 40n/an/an/an/an/an/an/an/a



University of Missouri St. Louis

Curated by ChEMBL


Assay Description
Irreversible inhibition of rat hormone sensitive lipase assessed as relative residual activity by kinetic analysis

Bioorg Med Chem 23: 944-52 (2015)


Article DOI: 10.1016/j.bmc.2015.01.028
BindingDB Entry DOI: 10.7270/Q23X88BP
More data for this
Ligand-Target Pair
Hormone-sensitive lipase


(Rattus norvegicus (Rat))		BDBM50064422
PNG
(CHEMBL3401162)
Show SMILES [H][C@@]12COC(=O)C1=C(C)O[P@](=O)(OCCCCCCCCCCCCCCCC)OC2 |r,t:7|
Show InChI InChI=1S/C23H41O6P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-27-30(25)28-19-21-18-26-23(24)22(21)20(2)29-30/h21H,3-19H2,1-2H3/t21-,30+/m0/s1
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n/an/a 25n/an/an/an/an/an/a



University of Missouri St. Louis

Curated by ChEMBL


Assay Description
Inhibition of rat hormone sensitive lipase assessed as oleic acid release from [3H]triolein by scintillation counting

Bioorg Med Chem 23: 944-52 (2015)


Article DOI: 10.1016/j.bmc.2015.01.028
BindingDB Entry DOI: 10.7270/Q23X88BP
More data for this
Ligand-Target Pair
Hormone-sensitive lipase


(Rattus norvegicus (Rat))		BDBM50064413
PNG
(CHEMBL3401168)
Show SMILES CCCCCCCCCCCCCCCCOP1(=O)OCCC(C(=O)OC)=C(C)O1 |t:26|
Show InChI InChI=1S/C23H43O6P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-27-30(25)28-20-18-22(21(2)29-30)23(24)26-3/h4-20H2,1-3H3
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n/an/a 60n/an/an/an/an/an/a



University of Missouri St. Louis

Curated by ChEMBL


Assay Description
Inhibition of rat hormone sensitive lipase assessed as oleic acid release from [3H]triolein by scintillation counting

Bioorg Med Chem 23: 944-52 (2015)


Article DOI: 10.1016/j.bmc.2015.01.028
BindingDB Entry DOI: 10.7270/Q23X88BP
More data for this
Ligand-Target Pair
Hormone-sensitive lipase


(Rattus norvegicus (Rat))		BDBM50064423
PNG
(CHEMBL3401161)
Show SMILES [H][C@]12COC(=O)C1=C(C)O[P@](=O)(OCCCCCCCCCCCCCCC)OC2 |r,t:7|
Show InChI InChI=1S/C22H39O6P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-26-29(24)27-18-20-17-25-22(23)21(20)19(2)28-29/h20H,3-18H2,1-2H3/t20-,29-/m1/s1
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n/an/a 75n/an/an/an/an/an/a



University of Missouri St. Louis

Curated by ChEMBL


Assay Description
Inhibition of rat hormone sensitive lipase assessed as oleic acid release from [3H]triolein by scintillation counting

Bioorg Med Chem 23: 944-52 (2015)


Article DOI: 10.1016/j.bmc.2015.01.028
BindingDB Entry DOI: 10.7270/Q23X88BP
More data for this
Ligand-Target Pair
Hormone-sensitive lipase


(Rattus norvegicus (Rat))		BDBM50064414
PNG
(CHEMBL3401167)
Show SMILES [H][C@]12COC(=O)C1=C(C)O[P@@](=O)(CC2)OCCCCCCCCCCCCCCCC |r,t:7|
Show InChI InChI=1S/C24H43O5P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-28-30(26)19-17-22-20-27-24(25)23(22)21(2)29-30/h22H,3-20H2,1-2H3/t22-,30+/m0/s1
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n/an/a 360n/an/an/an/an/an/a



University of Missouri St. Louis

Curated by ChEMBL


Assay Description
Inhibition of rat hormone sensitive lipase assessed as oleic acid release from [3H]triolein by scintillation counting

Bioorg Med Chem 23: 944-52 (2015)


Article DOI: 10.1016/j.bmc.2015.01.028
BindingDB Entry DOI: 10.7270/Q23X88BP
More data for this
Ligand-Target Pair
Hormone-sensitive lipase


(Rattus norvegicus (Rat))		BDBM50064421
PNG
(CHEMBL3401163)
Show SMILES [H][C@]12COC(=O)C1=C(C)O[P@](=O)(OCCCCCCCCCCCCCCCC)OC2 |r,t:7|
Show InChI InChI=1S/C23H41O6P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-27-30(25)28-19-21-18-26-23(24)22(21)20(2)29-30/h21H,3-19H2,1-2H3/t21-,30-/m1/s1
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n/an/a 420n/an/an/an/an/an/a



University of Missouri St. Louis

Curated by ChEMBL


Assay Description
Inhibition of rat hormone sensitive lipase assessed as oleic acid release from [3H]triolein by scintillation counting

Bioorg Med Chem 23: 944-52 (2015)


Article DOI: 10.1016/j.bmc.2015.01.028
BindingDB Entry DOI: 10.7270/Q23X88BP
More data for this
Ligand-Target Pair
Hormone-sensitive lipase


(Rattus norvegicus (Rat))		BDBM50064418
PNG
(CHEMBL3401164)
Show SMILES [H][C@@]12COC(=O)C1=C(C)O[P@@](=O)(CC2)OCCCCCCCCCCCCCCC |r,t:7|
Show InChI InChI=1S/C23H41O5P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-17-27-29(25)18-16-21-19-26-23(24)22(21)20(2)28-29/h21H,3-19H2,1-2H3/t21-,29-/m1/s1
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n/an/a 450n/an/an/an/an/an/a



University of Missouri St. Louis

Curated by ChEMBL


Assay Description
Inhibition of rat hormone sensitive lipase assessed as oleic acid release from [3H]triolein by scintillation counting

Bioorg Med Chem 23: 944-52 (2015)


Article DOI: 10.1016/j.bmc.2015.01.028
BindingDB Entry DOI: 10.7270/Q23X88BP
More data for this
Ligand-Target Pair
Hormone-sensitive lipase


(Rattus norvegicus (Rat))		BDBM50064416
PNG
(CHEMBL3401165)
Show SMILES [H][C@]12COC(=O)C1=C(C)O[P@@](=O)(CC2)OCCCCCCCCCCCCCCC |r,t:7|
Show InChI InChI=1S/C23H41O5P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-17-27-29(25)18-16-21-19-26-23(24)22(21)20(2)28-29/h21H,3-19H2,1-2H3/t21-,29+/m0/s1
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n/an/a 470n/an/an/an/an/an/a



University of Missouri St. Louis

Curated by ChEMBL


Assay Description
Inhibition of rat hormone sensitive lipase assessed as oleic acid release from [3H]triolein by scintillation counting

Bioorg Med Chem 23: 944-52 (2015)


Article DOI: 10.1016/j.bmc.2015.01.028
BindingDB Entry DOI: 10.7270/Q23X88BP
More data for this
Ligand-Target Pair
Hormone-sensitive lipase


(Rattus norvegicus (Rat))		BDBM50064425
PNG
(CHEMBL3401160)
Show SMILES [H][C@@]12COC(=O)C1=C(C)O[P@](=O)(OCCCCCCCCCCCCCCC)OC2 |r,t:7|
Show InChI InChI=1S/C22H39O6P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-26-29(24)27-18-20-17-25-22(23)21(20)19(2)28-29/h20H,3-18H2,1-2H3/t20-,29+/m0/s1
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n/an/a 900n/an/an/an/an/an/a



University of Missouri St. Louis

Curated by ChEMBL


Assay Description
Inhibition of rat hormone sensitive lipase assessed as oleic acid release from [3H]triolein by scintillation counting

Bioorg Med Chem 23: 944-52 (2015)


Article DOI: 10.1016/j.bmc.2015.01.028
BindingDB Entry DOI: 10.7270/Q23X88BP
More data for this
Ligand-Target Pair
Hormone-sensitive lipase


(Rattus norvegicus (Rat))		BDBM50064415
PNG
(CHEMBL3401166)
Show SMILES [H][C@@]12COC(=O)C1=C(C)O[P@@](=O)(CC2)OCCCCCCCCCCCCCCCC |r,t:7|
Show InChI InChI=1S/C24H43O5P/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-28-30(26)19-17-22-20-27-24(25)23(22)21(2)29-30/h22H,3-20H2,1-2H3/t22-,30-/m1/s1
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n/an/a 6.90E+3n/an/an/an/an/an/a



University of Missouri St. Louis

Curated by ChEMBL


Assay Description
Inhibition of rat hormone sensitive lipase assessed as oleic acid release from [3H]triolein by scintillation counting

Bioorg Med Chem 23: 944-52 (2015)


Article DOI: 10.1016/j.bmc.2015.01.028
BindingDB Entry DOI: 10.7270/Q23X88BP
More data for this
Ligand-Target Pair
Hormone-sensitive lipase


(Rattus norvegicus (Rat))		BDBM50064408
PNG
(CHEMBL3401171)
Show SMILES CCCCCCCCCCCCCCCC[C@H]1CC[P@@](=O)(OC)OC(C)=C1C(=O)OC |r,c:25|
Show InChI InChI=1S/C25H47O5P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-20-21-31(27,29-4)30-22(2)24(23)25(26)28-3/h23H,5-21H2,1-4H3/t23-,31+/m0/s1
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n/an/a 1.00E+4n/an/an/an/an/an/a



University of Missouri St. Louis

Curated by ChEMBL


Assay Description
Inhibition of rat hormone sensitive lipase assessed as oleic acid release from [3H]triolein by scintillation counting

Bioorg Med Chem 23: 944-52 (2015)


Article DOI: 10.1016/j.bmc.2015.01.028
BindingDB Entry DOI: 10.7270/Q23X88BP
More data for this
Ligand-Target Pair
Hormone-sensitive lipase


(Rattus norvegicus (Rat))		BDBM50064410
PNG
(CHEMBL3401170)
Show SMILES CCCCCCCCCCCC[C@H]1CC[P@@](=O)(OC)OC(C)=C1C(=O)OC |r,c:21|
Show InChI InChI=1S/C21H39O5P/c1-5-6-7-8-9-10-11-12-13-14-15-19-16-17-27(23,25-4)26-18(2)20(19)21(22)24-3/h19H,5-17H2,1-4H3/t19-,27+/m0/s1
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n/an/a 1.35E+4n/an/an/an/an/an/a



University of Missouri St. Louis

Curated by ChEMBL


Assay Description
Inhibition of rat hormone sensitive lipase assessed as oleic acid release from [3H]triolein by scintillation counting

Bioorg Med Chem 23: 944-52 (2015)


Article DOI: 10.1016/j.bmc.2015.01.028
BindingDB Entry DOI: 10.7270/Q23X88BP
More data for this
Ligand-Target Pair
Hormone-sensitive lipase


(Rattus norvegicus (Rat))		BDBM50064427
PNG
(CHEMBL3401172)
Show SMILES CCCCCCCCCCCCCCCCCC[C@H]1CC[P@@](=O)(OC)OC(C)=C1C(=O)OC |r,c:27|
Show InChI InChI=1S/C27H51O5P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-22-23-33(29,31-4)32-24(2)26(25)27(28)30-3/h25H,5-23H2,1-4H3/t25-,33+/m0/s1
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n/an/a 2.70E+4n/an/an/an/an/an/a



University of Missouri St. Louis

Curated by ChEMBL


Assay Description
Inhibition of rat hormone sensitive lipase assessed as oleic acid release from [3H]triolein by scintillation counting

Bioorg Med Chem 23: 944-52 (2015)


Article DOI: 10.1016/j.bmc.2015.01.028
BindingDB Entry DOI: 10.7270/Q23X88BP
More data for this
Ligand-Target Pair
Hormone-sensitive lipase


(Rattus norvegicus (Rat))		BDBM50064411
PNG
(CHEMBL2179369)
Show SMILES CCCCCCCCCCCC[C@@H]1CC[P@@](=O)(OC)OC(C)=C1C(=O)OC |r,c:21|
Show InChI InChI=1S/C21H39O5P/c1-5-6-7-8-9-10-11-12-13-14-15-19-16-17-27(23,25-4)26-18(2)20(19)21(22)24-3/h19H,5-17H2,1-4H3/t19-,27-/m1/s1
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n/an/a 3.50E+4n/an/an/an/an/an/a



University of Missouri St. Louis

Curated by ChEMBL


Assay Description
Inhibition of rat hormone sensitive lipase assessed as oleic acid release from [3H]triolein by scintillation counting

Bioorg Med Chem 23: 944-52 (2015)


Article DOI: 10.1016/j.bmc.2015.01.028
BindingDB Entry DOI: 10.7270/Q23X88BP
More data for this
Ligand-Target Pair
Hormone-sensitive lipase


(Rattus norvegicus (Rat))		BDBM50064409
PNG
(CHEMBL2179367)
Show SMILES CCCCCCCCCCCCCCCC[C@@H]1CC[P@@](=O)(OC)OC(C)=C1C(=O)OC |r,c:25|
Show InChI InChI=1S/C25H47O5P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23-20-21-31(27,29-4)30-22(2)24(23)25(26)28-3/h23H,5-21H2,1-4H3/t23-,31-/m1/s1
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n/an/a 6.00E+4n/an/an/an/an/an/a



University of Missouri St. Louis

Curated by ChEMBL


Assay Description
Inhibition of rat hormone sensitive lipase assessed as oleic acid release from [3H]triolein by scintillation counting

Bioorg Med Chem 23: 944-52 (2015)


Article DOI: 10.1016/j.bmc.2015.01.028
BindingDB Entry DOI: 10.7270/Q23X88BP
More data for this
Ligand-Target Pair
Hormone-sensitive lipase


(Rattus norvegicus (Rat))		BDBM50064412
PNG
(CHEMBL3401169)
Show SMILES CCCCCCCCCCCCCCCCOP1(=O)OC(C)=C(CCC1(F)F)C(=O)OC |c:21|
Show InChI InChI=1S/C24H43F2O5P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-30-32(28)24(25,26)19-18-22(21(2)31-32)23(27)29-3/h4-20H2,1-3H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Missouri St. Louis

Curated by ChEMBL


Assay Description
Inhibition of rat hormone sensitive lipase assessed as oleic acid release from [3H]triolein by scintillation counting

Bioorg Med Chem 23: 944-52 (2015)


Article DOI: 10.1016/j.bmc.2015.01.028
BindingDB Entry DOI: 10.7270/Q23X88BP
More data for this
Ligand-Target Pair
Hormone-sensitive lipase


(Rattus norvegicus (Rat))		BDBM50064426
PNG
(CHEMBL3401159)
Show SMILES [H][C@@]12COC(=O)C1=C(C)O[P@](=O)(OC)OC2 |r,t:7|
Show InChI InChI=1S/C8H11O6P/c1-5-7-6(3-12-8(7)9)4-13-15(10,11-2)14-5/h6H,3-4H2,1-2H3/t6-,15+/m0/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Missouri St. Louis

Curated by ChEMBL


Assay Description
Inhibition of rat hormone sensitive lipase assessed as oleic acid release from [3H]triolein by scintillation counting

Bioorg Med Chem 23: 944-52 (2015)


Article DOI: 10.1016/j.bmc.2015.01.028
BindingDB Entry DOI: 10.7270/Q23X88BP
More data for this
Ligand-Target Pair
Hormone-sensitive lipase


(Rattus norvegicus (Rat))		BDBM50064428
PNG
(CHEMBL2179365)
Show SMILES CCCCCCCCCCCCCCCCCC[C@@H]1CC[P@@](=O)(OC)OC(C)=C1C(=O)OC |r,c:27|
Show InChI InChI=1S/C27H51O5P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-22-23-33(29,31-4)32-24(2)26(25)27(28)30-3/h25H,5-23H2,1-4H3/t25-,33-/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Missouri St. Louis

Curated by ChEMBL


Assay Description
Inhibition of rat hormone sensitive lipase assessed as oleic acid release from [3H]triolein by scintillation counting

Bioorg Med Chem 23: 944-52 (2015)


Article DOI: 10.1016/j.bmc.2015.01.028
BindingDB Entry DOI: 10.7270/Q23X88BP
More data for this
Ligand-Target Pair
Hormone-sensitive lipase


(Rattus norvegicus (Rat))		BDBM50308520
PNG
(CHEMBL603622 | cyclophostin)
Show SMILES CO[P@]1(=O)OC[C@H]2COC(=O)C2=C(C)O1 |r,t:12|
Show InChI InChI=1S/C8H11O6P/c1-5-7-6(3-12-8(7)9)4-13-15(10,11-2)14-5/h6H,3-4H2,1-2H3/t6-,15-/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Missouri St. Louis

Curated by ChEMBL


Assay Description
Inhibition of rat hormone sensitive lipase assessed as oleic acid release from [3H]triolein by scintillation counting

Bioorg Med Chem 23: 944-52 (2015)


Article DOI: 10.1016/j.bmc.2015.01.028
BindingDB Entry DOI: 10.7270/Q23X88BP
More data for this
Ligand-Target Pair
Hormone-sensitive lipase


(Rattus norvegicus (Rat))		BDBM50308513
PNG
((3R,8aR)-3-Methoxy-5-methyl-3-oxo-8,8a-dihydro-1H-...)
Show SMILES CO[P@@]1(=O)CC[C@H]2COC(=O)C2=C(C)O1 |r,t:12|
Show InChI InChI=1S/C9H13O5P/c1-6-8-7(5-13-9(8)10)3-4-15(11,12-2)14-6/h7H,3-5H2,1-2H3/t7-,15-/m0/s1
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n/an/a 1.00E+5n/an/an/an/an/an/a



University of Missouri St. Louis

Curated by ChEMBL


Assay Description
Inhibition of rat hormone sensitive lipase assessed as oleic acid release from [3H]triolein by scintillation counting

Bioorg Med Chem 23: 944-52 (2015)


Article DOI: 10.1016/j.bmc.2015.01.028
BindingDB Entry DOI: 10.7270/Q23X88BP
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%