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Compile Data Set for Download or QSAR

Found 97 hits with Last Name = 'ackerman' and Initial = 'jh'   
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
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029704
PNG
(2-(4-Benzyl-5-oxo-2,5-dihydro-furan-3-yloxymethyl)...)
Show SMILES COc1cc2c(C(=O)N(COC3=C(Cc4ccccc4)C(=O)OC3)S2(=O)=O)c(c1)C(C)C
Show InChI InChI=1S/C23H23NO7S/c1-14(2)17-10-16(29-3)11-20-21(17)22(25)24(32(20,27)28)13-31-19-12-30-23(26)18(19)9-15-7-5-4-6-8-15/h4-8,10-11,14H,9,12-13H2,1-3H3
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0.0130n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029709
PNG
(2-(4-Benzyl-2-methyl-5-oxo-2,5-dihydro-furan-3-ylo...)
Show SMILES COc1cc2c(C(=O)N(COC3=C(Cc4ccccc4)C(=O)OC3C)S2(=O)=O)c(c1)C(C)C
Show InChI InChI=1S/C24H25NO7S/c1-14(2)18-11-17(30-4)12-20-21(18)23(26)25(33(20,28)29)13-31-22-15(3)32-24(27)19(22)10-16-8-6-5-7-9-16/h5-9,11-12,14-15H,10,13H2,1-4H3
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0.0160n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029710
PNG
(4-Isopropyl-6-methoxy-2-(2-methyl-5-oxo-4-phenyl-2...)
Show SMILES COc1cc2c(C(=O)N(COC3=C(C(=O)OC3C)c3ccccc3)S2(=O)=O)c(c1)C(C)C
Show InChI InChI=1S/C23H23NO7S/c1-13(2)17-10-16(29-4)11-18-20(17)22(25)24(32(18,27)28)12-30-21-14(3)31-23(26)19(21)15-8-6-5-7-9-15/h5-11,13-14H,12H2,1-4H3
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0.0210n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029699
PNG
(2,6-Dichloro-benzoic acid 4-isopropyl-6-methoxy-1,...)
Show SMILES COc1cc2c(C(=O)N(COC(=O)c3c(Cl)cccc3Cl)S2(=O)=O)c(c1)C(C)C
Show InChI InChI=1S/C19H17Cl2NO6S/c1-10(2)12-7-11(27-3)8-15-16(12)18(23)22(29(15,25)26)9-28-19(24)17-13(20)5-4-6-14(17)21/h4-8,10H,9H2,1-3H3
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0.0230n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029698
PNG
(4-Isopropyl-6-methoxy-1,1-dioxo-2-(5-oxo-4-phenyl-...)
Show SMILES COc1cc2c(C(=O)N(COC3=C(C(=O)OC3)c3ccccc3)S2(=O)=O)c(c1)C(C)C
Show InChI InChI=1S/C22H21NO7S/c1-13(2)16-9-15(28-3)10-18-20(16)21(24)23(31(18,26)27)12-30-17-11-29-22(25)19(17)14-7-5-4-6-8-14/h4-10,13H,11-12H2,1-3H3
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0.0250n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029717
PNG
(2-(3-Chloro-6-methyl-2-oxo-2H-pyran-4-yloxymethyl)...)
Show SMILES COc1cc2c(C(=O)N(COc3cc(C)oc(=O)c3Cl)S2(=O)=O)c(c1)C(C)C
Show InChI InChI=1S/C18H18ClNO7S/c1-9(2)12-6-11(25-4)7-14-15(12)17(21)20(28(14,23)24)8-26-13-5-10(3)27-18(22)16(13)19/h5-7,9H,8H2,1-4H3
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0.0250n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029696
PNG
(2-(3-Benzoyl-6-methyl-2-oxo-2H-pyran-4-yloxymethyl...)
Show SMILES COc1cc2c(C(=O)N(COc3cc(C)oc(=O)c3C(=O)c3ccccc3)S2(=O)=O)c(c1)C(C)C
Show InChI InChI=1S/C25H23NO8S/c1-14(2)18-11-17(32-4)12-20-21(18)24(28)26(35(20,30)31)13-33-19-10-15(3)34-25(29)22(19)23(27)16-8-6-5-7-9-16/h5-12,14H,13H2,1-4H3
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0.0270n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029712
PNG
(2-(4-Chloro-5-oxo-2,5-dihydro-furan-3-yloxymethyl)...)
Show SMILES COc1cc2c(C(=O)N(COC3=C(Cl)C(=O)OC3)S2(=O)=O)c(c1)C(C)C
Show InChI InChI=1S/C16H16ClNO7S/c1-8(2)10-4-9(23-3)5-12-13(10)15(19)18(26(12,21)22)7-25-11-6-24-16(20)14(11)17/h4-5,8H,6-7H2,1-3H3
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0.0300n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029713
PNG
(4-Isopropyl-6-methoxy-1,1-dioxo-2-(3-oxo-cyclobut-...)
Show SMILES COc1cc2c(C(=O)N(COC3=CC(=O)C3)S2(=O)=O)c(c1)C(C)C
Show InChI InChI=1S/C16H17NO6S/c1-9(2)13-6-11(22-3)7-14-15(13)16(19)17(24(14,20)21)8-23-12-4-10(18)5-12/h4,6-7,9H,5,8H2,1-3H3
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0.0330n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029691
PNG
(2-(2-Benzyl-3-oxo-cyclopent-1-enyloxymethyl)-4-iso...)
Show SMILES COc1cc2c(C(=O)N(COC3=C(Cc4ccccc4)C(=O)CC3)S2(=O)=O)c(c1)C(C)C
Show InChI InChI=1S/C24H25NO6S/c1-15(2)18-12-17(30-3)13-22-23(18)24(27)25(32(22,28)29)14-31-21-10-9-20(26)19(21)11-16-7-5-4-6-8-16/h4-8,12-13,15H,9-11,14H2,1-3H3
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0.0340n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029692
PNG
(4-Isopropyl-6-methoxy-2-(6-methyl-2-oxo-2H-pyran-4...)
Show SMILES COc1cc2c(C(=O)N(COc3cc(C)oc(=O)c3)S2(=O)=O)c(c1)C(C)C
Show InChI InChI=1S/C18H19NO7S/c1-10(2)14-6-12(24-4)7-15-17(14)18(21)19(27(15,22)23)9-25-13-5-11(3)26-16(20)8-13/h5-8,10H,9H2,1-4H3
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0.0500n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029695
PNG
(4-Isopropyl-6-methoxy-1,1-dioxo-2-(5-oxo-2,5-dihyd...)
Show SMILES COc1cc2c(C(=O)N(COC3=CC(=O)OC3)S2(=O)=O)c(c1)C(C)C
Show InChI InChI=1S/C16H17NO7S/c1-9(2)12-4-10(22-3)5-13-15(12)16(19)17(25(13,20)21)8-24-11-6-14(18)23-7-11/h4-6,9H,7-8H2,1-3H3
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0.0520n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029711
PNG
(3-Bromo-2-(4-isopropyl-6-methoxy-1,1,3-trioxo-1,3-...)
Show SMILES COc1cc2c(C(=O)N(COc3nc4ccccn4c(=O)c3Br)S2(=O)=O)c(c1)C(C)C
Show InChI InChI=1S/C20H18BrN3O6S/c1-11(2)13-8-12(29-3)9-14-16(13)19(25)24(31(14,27)28)10-30-18-17(21)20(26)23-7-5-4-6-15(23)22-18/h4-9,11H,10H2,1-3H3
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0.0580n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029720
PNG
(4-Isopropyl-6-methoxy-2-(2-methyl-3-oxo-cyclopent-...)
Show SMILES COc1cc2c(C(=O)N(COC3=C(C)C(=O)CC3)S2(=O)=O)c(c1)C(C)C
Show InChI InChI=1S/C18H21NO6S/c1-10(2)13-7-12(24-4)8-16-17(13)18(21)19(26(16,22)23)9-25-15-6-5-14(20)11(15)3/h7-8,10H,5-6,9H2,1-4H3
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0.0600n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029707
PNG
(3-Chloro-2-(4-isopropyl-6-methoxy-1,1,3-trioxo-1,3...)
Show SMILES COc1cc2c(C(=O)N(COc3nc4ccccn4c(=O)c3Cl)S2(=O)=O)c(c1)C(C)C
Show InChI InChI=1S/C20H18ClN3O6S/c1-11(2)13-8-12(29-3)9-14-16(13)19(25)24(31(14,27)28)10-30-18-17(21)20(26)23-7-5-4-6-15(23)22-18/h4-9,11H,10H2,1-3H3
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0.0660n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029721
PNG
(2-(4-Isopropyl-6-methoxy-1,1,3-trioxo-1,3-dihydro-...)
Show SMILES COc1cc2c(C(=O)N(COc3cc(=O)n4ccccc4n3)S2(=O)=O)c(c1)C(C)C
Show InChI InChI=1S/C20H19N3O6S/c1-12(2)14-8-13(28-3)9-15-19(14)20(25)23(30(15,26)27)11-29-17-10-18(24)22-7-5-4-6-16(22)21-17/h4-10,12H,11H2,1-3H3
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0.0780n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029715
PNG
(4-Isopropyl-6-methoxy-1,1-dioxo-2-(3-oxo-3H-inden-...)
Show SMILES COc1cc2c(C(=O)N(COC3=CC(=O)c4ccccc34)S2(=O)=O)c(c1)C(C)C
Show InChI InChI=1S/C21H19NO6S/c1-12(2)16-8-13(27-3)9-19-20(16)21(24)22(29(19,25)26)11-28-18-10-17(23)14-6-4-5-7-15(14)18/h4-10,12H,11H2,1-3H3
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0.0830n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029718
PNG
(4-Isopropyl-6-methoxy-1,1-dioxo-2-(2-oxo-2H-chrome...)
Show SMILES COc1cc2c(C(=O)N(COc3cc(=O)oc4ccccc34)S2(=O)=O)c(c1)C(C)C
Show InChI InChI=1S/C21H19NO7S/c1-12(2)15-8-13(27-3)9-18-20(15)21(24)22(30(18,25)26)11-28-17-10-19(23)29-16-7-5-4-6-14(16)17/h4-10,12H,11H2,1-3H3
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0.0900n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029700
PNG
(4-Isopropyl-6-methoxy-2-(2-methyl-5-oxo-2,5-dihydr...)
Show SMILES COc1cc2c(C(=O)N(COC3=CC(=O)OC3C)S2(=O)=O)c(c1)C(C)C
Show InChI InChI=1S/C17H19NO7S/c1-9(2)12-5-11(23-4)6-14-16(12)17(20)18(26(14,21)22)8-24-13-7-15(19)25-10(13)3/h5-7,9-10H,8H2,1-4H3
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0.0930n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029706
PNG
(2-(4-Isopropyl-6-methoxy-1,1,3-trioxo-1,3-dihydro-...)
Show SMILES COc1cc2c(C(=O)N(COc3cc(=O)n4CCCCc4n3)S2(=O)=O)c(c1)C(C)C
Show InChI InChI=1S/C20H23N3O6S/c1-12(2)14-8-13(28-3)9-15-19(14)20(25)23(30(15,26)27)11-29-17-10-18(24)22-7-5-4-6-16(22)21-17/h8-10,12H,4-7,11H2,1-3H3
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0.110n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029716
PNG
(2-(1-Benzyl-5-oxo-2,5-dihydro-1H-pyrrol-3-yloxymet...)
Show SMILES COc1cc2c(C(=O)N(COC3=CC(=O)N(Cc4ccccc4)C3)S2(=O)=O)c(c1)C(C)C
Show InChI InChI=1S/C23H24N2O6S/c1-15(2)19-9-17(30-3)10-20-22(19)23(27)25(32(20,28)29)14-31-18-11-21(26)24(13-18)12-16-7-5-4-6-8-16/h4-11,15H,12-14H2,1-3H3
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0.140n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029708
PNG
(4-Isopropyl-6-methoxy-2-(2-methyl-3-oxo-cyclohex-1...)
Show SMILES COc1cc2c(C(=O)N(COC3=C(C)C(=O)CCC3)S2(=O)=O)c(c1)C(C)C
Show InChI InChI=1S/C19H23NO6S/c1-11(2)14-8-13(25-4)9-17-18(14)19(22)20(27(17,23)24)10-26-16-7-5-6-15(21)12(16)3/h8-9,11H,5-7,10H2,1-4H3
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0.180n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029702
PNG
(3-Chloro-2-(4-isopropyl-1,1,3-trioxo-1,3-dihydro-1...)
Show SMILES CC(C)c1cccc2c1C(=O)N(COc1nc3ccccn3c(=O)c1Cl)S2(=O)=O
Show InChI InChI=1S/C19H16ClN3O5S/c1-11(2)12-6-5-7-13-15(12)18(24)23(29(13,26)27)10-28-17-16(20)19(25)22-9-4-3-8-14(22)21-17/h3-9,11H,10H2,1-2H3
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0.210n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029693
PNG
(4-Isopropyl-6-methoxy-1,1-dioxo-2-(2-oxo-2H-thioch...)
Show SMILES COc1cc2c(C(=O)N(COc3cc(=O)sc4ccccc34)S2(=O)=O)c(c1)C(C)C
Show InChI InChI=1S/C21H19NO6S2/c1-12(2)15-8-13(27-3)9-18-20(15)21(24)22(30(18,25)26)11-28-16-10-19(23)29-17-7-5-4-6-14(16)17/h4-10,12H,11H2,1-3H3
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0.220n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029714
PNG
(2-(4-Isopropyl-6-methoxy-1,1,3-trioxo-1,3-dihydro-...)
Show SMILES COc1cc2c(C(=O)N(COc3nc4ccccn4c(=O)c3C)S2(=O)=O)c(c1)C(C)C
Show InChI InChI=1S/C21H21N3O6S/c1-12(2)15-9-14(29-4)10-16-18(15)21(26)24(31(16,27)28)11-30-19-13(3)20(25)23-8-6-5-7-17(23)22-19/h5-10,12H,11H2,1-4H3
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0.25n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029703
PNG
(4-Isopropyl-6-methoxy-1,1-dioxo-2-(1-phenyl-1H-tet...)
Show SMILES COc1cc2c(C(=O)N(CSc3nnnn3-c3ccccc3)S2(=O)=O)c(c1)C(C)C
Show InChI InChI=1S/C19H19N5O4S2/c1-12(2)15-9-14(28-3)10-16-17(15)18(25)23(30(16,26)27)11-29-19-20-21-22-24(19)13-7-5-4-6-8-13/h4-10,12H,11H2,1-3H3
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0.270n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029705
PNG
(4-(4-Isopropyl-6-methoxy-1,1,3-trioxo-1,3-dihydro-...)
Show SMILES COc1cc2c(C(=O)N(COc3cc(=O)n(C)c4ccccc34)S2(=O)=O)c(c1)C(C)C
Show InChI InChI=1S/C22H22N2O6S/c1-13(2)16-9-14(29-4)10-19-21(16)22(26)24(31(19,27)28)12-30-18-11-20(25)23(3)17-8-6-5-7-15(17)18/h5-11,13H,12H2,1-4H3
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0.5n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029694
PNG
(2-(4-sec-Butyl-1,1,3-trioxo-1,3-dihydro-1lambda*6*...)
Show SMILES CCC(C)c1cccc2c1C(=O)N(COc1nc3ccccn3c(=O)c1Cl)S2(=O)=O
Show InChI InChI=1S/C20H18ClN3O5S/c1-3-12(2)13-7-6-8-14-16(13)19(25)24(30(14,27)28)11-29-18-17(21)20(26)23-10-5-4-9-15(23)22-18/h4-10,12H,3,11H2,1-2H3
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0.720n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029719
PNG
(2-(1,6-Dimethyl-2-oxo-1,2-dihydro-pyridin-4-yloxym...)
Show SMILES COc1cc2c(C(=O)N(COc3cc(C)n(C)c(=O)c3)S2(=O)=O)c(c1)C(C)C
Show InChI InChI=1S/C19H22N2O6S/c1-11(2)15-7-13(26-5)8-16-18(15)19(23)21(28(16,24)25)10-27-14-6-12(3)20(4)17(22)9-14/h6-9,11H,10H2,1-5H3
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0.850n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029701
PNG
(3-Benzyl-2-(4-isopropyl-6-methoxy-1,1,3-trioxo-1,3...)
Show SMILES COc1cc2c(C(=O)N(COc3nc4ccccn4c(=O)c3Cc3ccccc3)S2(=O)=O)c(c1)C(C)C
Show InChI InChI=1S/C27H25N3O6S/c1-17(2)20-14-19(35-3)15-22-24(20)27(32)30(37(22,33)34)16-36-25-21(13-18-9-5-4-6-10-18)26(31)29-12-8-7-11-23(29)28-25/h4-12,14-15,17H,13,16H2,1-3H3
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0.900n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Leukocyte elastase


(Homo sapiens (Human))
BDBM50029697
PNG
(3-Chloro-2-(1,1,3-trioxo-1,3-dihydro-1lambda*6*-be...)
Show SMILES Clc1c(OCN2C(=O)c3ccccc3S2(=O)=O)nc2ccccn2c1=O
Show InChI InChI=1S/C16H10ClN3O5S/c17-13-14(18-12-7-3-4-8-19(12)16(13)22)25-9-20-15(21)10-5-1-2-6-11(10)26(20,23)24/h1-8H,9H2
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14n/an/an/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Potency of inhibition of human leukocyte elastase is expressed as apparent binding constant


J Med Chem 38: 4687-92 (1995)


Article DOI: 10.1021/jm00023a008
BindingDB Entry DOI: 10.7270/Q2KP816X
More data for this
Ligand-Target Pair
Cannabinoid receptor


(Rattus norvegicus (rat))
BDBM50032599
PNG
((4-Methoxy-naphthalen-1-yl)-[1-(2-morpholin-4-yl-e...)
Show SMILES COc1ccc(C(=O)c2cn(CCN3CCOCC3)c3ccccc23)c2ccccc12
Show InChI InChI=1S/C26H26N2O3/c1-30-25-11-10-22(19-6-2-3-8-21(19)25)26(29)23-18-28(24-9-5-4-7-20(23)24)13-12-27-14-16-31-17-15-27/h2-11,18H,12-17H2,1H3
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n/an/a 1.40n/an/an/an/an/an/a



Sanofi Research Division

Curated by ChEMBL


Assay Description
Concentration of compound required to inhibit 50% of [3H]-WIN- 55212 binding to Cannabinoid receptor 1 in rat cerebellum membranes.


J Med Chem 38: 3094-105 (1995)


Article DOI: 10.1021/jm00016a013
BindingDB Entry DOI: 10.7270/Q2DN442Z
More data for this
Ligand-Target Pair
Cannabinoid receptor


(Rattus norvegicus (rat))
BDBM50032565
PNG
((4-Methyl-naphthalen-1-yl)-[1-(2-morpholin-4-yl-et...)
Show SMILES Cc1ccc(C(=O)c2cn(CCN3CCOCC3)c3ccccc23)c2ccccc12
Show InChI InChI=1S/C26H26N2O2/c1-19-10-11-23(21-7-3-2-6-20(19)21)26(29)24-18-28(25-9-5-4-8-22(24)25)13-12-27-14-16-30-17-15-27/h2-11,18H,12-17H2,1H3
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n/an/a 2.80n/an/an/an/an/an/a



Sanofi Research Division

Curated by ChEMBL


Assay Description
Concentration of compound required to inhibit 50% of [3H]-WIN- 55212 binding to Cannabinoid receptor 1 in rat cerebellum membranes.


J Med Chem 38: 3094-105 (1995)


Article DOI: 10.1021/jm00016a013
BindingDB Entry DOI: 10.7270/Q2DN442Z
More data for this
Ligand-Target Pair
Cannabinoid receptor


(Rattus norvegicus (rat))
BDBM50032584
PNG
((4-Hydroxy-naphthalen-1-yl)-[1-(2-morpholin-4-yl-e...)
Show SMILES Oc1ccc(C(=O)c2cn(CCN3CCOCC3)c3ccccc23)c2ccccc12
Show InChI InChI=1S/C25H24N2O3/c28-24-10-9-21(18-5-1-2-7-20(18)24)25(29)22-17-27(23-8-4-3-6-19(22)23)12-11-26-13-15-30-16-14-26/h1-10,17,28H,11-16H2
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n/an/a 3.40n/an/an/an/an/an/a



Sanofi Research Division

Curated by ChEMBL


Assay Description
Concentration of compound required to inhibit 50% of [3H]-WIN- 55212 binding to Cannabinoid receptor 1 in rat cerebellum membranes.


J Med Chem 38: 3094-105 (1995)


Article DOI: 10.1021/jm00016a013
BindingDB Entry DOI: 10.7270/Q2DN442Z
More data for this
Ligand-Target Pair
Cannabinoid receptor


(Rattus norvegicus (rat))
BDBM50032615
PNG
(CHEMBL82361 | [6-Methyl-1-(2-morpholin-4-yl-ethyl)...)
Show SMILES Cc1ccc2c(cn(CCN3CCOCC3)c2c1)C(=O)c1cccc2ccccc12
Show InChI InChI=1S/C26H26N2O2/c1-19-9-10-22-24(26(29)23-8-4-6-20-5-2-3-7-21(20)23)18-28(25(22)17-19)12-11-27-13-15-30-16-14-27/h2-10,17-18H,11-16H2,1H3
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n/an/a 3.5n/an/an/an/an/an/a



Sanofi Research Division

Curated by ChEMBL


Assay Description
Concentration of compound required to inhibit 50% of [3H]-WIN- 55212 binding to Cannabinoid receptor 1 in rat cerebellum membranes.


J Med Chem 38: 3094-105 (1995)


Article DOI: 10.1021/jm00016a013
BindingDB Entry DOI: 10.7270/Q2DN442Z
More data for this
Ligand-Target Pair
Cannabinoid receptor


(Rattus norvegicus (rat))
BDBM60994
PNG
((10R,10aR)-6,6,9-Trimethyl-3-pentyl-6a,7,8,10a-tet...)
Show SMILES CCCCCc1cc(O)c2[C@@H]3C=C(C)CC[C@H]3C(C)(C)Oc2c1
Show InChI InChI=1S/C21H30O2/c1-5-6-7-8-15-12-18(22)20-16-11-14(2)9-10-17(16)21(3,4)23-19(20)13-15/h11-13,16-17,22H,5-10H2,1-4H3/t16-,17-/m1/s1
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n/an/a 5.80n/an/an/an/an/an/a



Sanofi Research Division

Curated by ChEMBL


Assay Description
Concentration of compound required to inhibit 50% of [3H]-WIN- 55212 binding to Cannabinoid receptor 1 in rat cerebellum membranes.


J Med Chem 38: 3094-105 (1995)


Article DOI: 10.1021/jm00016a013
BindingDB Entry DOI: 10.7270/Q2DN442Z
More data for this
Ligand-Target Pair
Cannabinoid receptor


(Rattus norvegicus (rat))
BDBM50032575
PNG
(CHEMBL309763 | [2-Methyl-1-(2-morpholin-4-yl-ethyl...)
Show SMILES Cc1c(C(=O)c2ccc(C)c3ccccc23)c2ccccc2n1CCN1CCOCC1
Show InChI InChI=1S/C27H28N2O2/c1-19-11-12-23(22-8-4-3-7-21(19)22)27(30)26-20(2)29(25-10-6-5-9-24(25)26)14-13-28-15-17-31-18-16-28/h3-12H,13-18H2,1-2H3
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n/an/a 5.90n/an/an/an/an/an/a



Sanofi Research Division

Curated by ChEMBL


Assay Description
Concentration of compound required to inhibit 50% of [3H]-WIN- 55212 binding to Cannabinoid receptor 1 in rat cerebellum membranes.


J Med Chem 38: 3094-105 (1995)


Article DOI: 10.1021/jm00016a013
BindingDB Entry DOI: 10.7270/Q2DN442Z
More data for this
Ligand-Target Pair
Cannabinoid receptor


(Rattus norvegicus (rat))
BDBM50032583
PNG
((4-Bromo-naphthalen-1-yl)-[2-methyl-1-(2-morpholin...)
Show SMILES Cc1c(C(=O)c2ccc(Br)c3ccccc23)c2ccccc2n1CCN1CCOCC1
Show InChI InChI=1S/C26H25BrN2O2/c1-18-25(26(30)21-10-11-23(27)20-7-3-2-6-19(20)21)22-8-4-5-9-24(22)29(18)13-12-28-14-16-31-17-15-28/h2-11H,12-17H2,1H3
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n/an/a 6.90n/an/an/an/an/an/a



Sanofi Research Division

Curated by ChEMBL


Assay Description
Concentration of compound required to inhibit 50% of [3H]-WIN- 55212 binding to Cannabinoid receptor 1 in rat cerebellum membranes.


J Med Chem 38: 3094-105 (1995)


Article DOI: 10.1021/jm00016a013
BindingDB Entry DOI: 10.7270/Q2DN442Z
More data for this
Ligand-Target Pair
Cannabinoid receptor


(Rattus norvegicus (rat))
BDBM50009854
PNG
(CHEMBL13078 | [1-(2-Morpholin-4-yl-ethyl)-1H-indol...)
Show SMILES O=C(c1cn(CCN2CCOCC2)c2ccccc12)c1cccc2ccccc12
Show InChI InChI=1S/C25H24N2O2/c28-25(22-10-5-7-19-6-1-2-8-20(19)22)23-18-27(24-11-4-3-9-21(23)24)13-12-26-14-16-29-17-15-26/h1-11,18H,12-17H2
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n/an/a 7.80n/an/an/an/an/an/a



Sanofi Research Division

Curated by ChEMBL


Assay Description
Concentration of compound required to inhibit 50% of [3H]-WIN- 55212 binding to Cannabinoid receptor 1 in rat cerebellum membranes.


J Med Chem 38: 3094-105 (1995)


Article DOI: 10.1021/jm00016a013
BindingDB Entry DOI: 10.7270/Q2DN442Z
More data for this
Ligand-Target Pair
Cannabinoid receptor


(Rattus norvegicus (rat))
BDBM50032589
PNG
(CHEMBL78415 | [7-Methoxy-2-methyl-1-(2-morpholin-4...)
Show SMILES COc1cccc2c(C(=O)c3cccc4ccccc34)c(C)n(CCN3CCOCC3)c12
Show InChI InChI=1S/C27H28N2O3/c1-19-25(27(30)22-10-5-8-20-7-3-4-9-21(20)22)23-11-6-12-24(31-2)26(23)29(19)14-13-28-15-17-32-18-16-28/h3-12H,13-18H2,1-2H3
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n/an/a 10n/an/an/an/an/an/a



Sanofi Research Division

Curated by ChEMBL


Assay Description
Concentration of compound required to inhibit 50% of [3H]-WIN- 55212 binding to Cannabinoid receptor 1 in rat cerebellum membranes.


J Med Chem 38: 3094-105 (1995)


Article DOI: 10.1021/jm00016a013
BindingDB Entry DOI: 10.7270/Q2DN442Z
More data for this
Ligand-Target Pair
Cannabinoid receptor


(Rattus norvegicus (rat))
BDBM50032621
PNG
(CHEMBL78713 | [2-Chloro-1-(2-morpholin-4-yl-ethyl)...)
Show SMILES Clc1c(C(=O)c2cccc3ccccc23)c2ccccc2n1CCN1CCOCC1
Show InChI InChI=1S/C25H23ClN2O2/c26-25-23(24(29)20-10-5-7-18-6-1-2-8-19(18)20)21-9-3-4-11-22(21)28(25)13-12-27-14-16-30-17-15-27/h1-11H,12-17H2
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n/an/a 10n/an/an/an/an/an/a



Sanofi Research Division

Curated by ChEMBL


Assay Description
Concentration of compound required to inhibit 50% of [3H]-WIN- 55212 binding to Cannabinoid receptor 1 in rat cerebellum membranes.


J Med Chem 38: 3094-105 (1995)


Article DOI: 10.1021/jm00016a013
BindingDB Entry DOI: 10.7270/Q2DN442Z
More data for this
Ligand-Target Pair
Cannabinoid receptor


(Rattus norvegicus (rat))
BDBM50032616
PNG
(CHEMBL78940 | [6-Bromo-2-methyl-1-(2-morpholin-4-y...)
Show SMILES Cc1c(C(=O)c2cccc3ccccc23)c2ccc(Br)cc2n1CCN1CCOCC1
Show InChI InChI=1S/C26H25BrN2O2/c1-18-25(26(30)22-8-4-6-19-5-2-3-7-21(19)22)23-10-9-20(27)17-24(23)29(18)12-11-28-13-15-31-16-14-28/h2-10,17H,11-16H2,1H3
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n/an/a 10n/an/an/an/an/an/a



Sanofi Research Division

Curated by ChEMBL


Assay Description
Concentration of compound required to inhibit 50% of [3H]-WIN- 55212 binding to Cannabinoid receptor 1 in rat cerebellum membranes.


J Med Chem 38: 3094-105 (1995)


Article DOI: 10.1021/jm00016a013
BindingDB Entry DOI: 10.7270/Q2DN442Z
More data for this
Ligand-Target Pair
Cannabinoid receptor


(Rattus norvegicus (rat))
BDBM50032560
PNG
(CHEMBL78994 | [2,6-Dimethyl-1-(2-morpholin-4-yl-et...)
Show SMILES Cc1c(C(=O)c2cccc3ccccc23)c2ccc(C)cc2n1CCN1CCOCC1
Show InChI InChI=1S/C27H28N2O2/c1-19-10-11-24-25(18-19)29(13-12-28-14-16-31-17-15-28)20(2)26(24)27(30)23-9-5-7-21-6-3-4-8-22(21)23/h3-11,18H,12-17H2,1-2H3
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n/an/a 11n/an/an/an/an/an/a



Sanofi Research Division

Curated by ChEMBL


Assay Description
Concentration of compound required to inhibit 50% of [3H]-WIN- 55212 binding to Cannabinoid receptor 1 in rat cerebellum membranes.


J Med Chem 38: 3094-105 (1995)


Article DOI: 10.1021/jm00016a013
BindingDB Entry DOI: 10.7270/Q2DN442Z
More data for this
Ligand-Target Pair
Cannabinoid receptor


(Rattus norvegicus (rat))
BDBM50032561
PNG
(CHEMBL104841 | [2-Methyl-1-(1-methyl-2-morpholin-4...)
Show SMILES CC(CN1CCOCC1)n1c(C)c(C(=O)c2cccc3ccccc23)c2ccccc12
Show InChI InChI=1S/C27H28N2O2/c1-19(18-28-14-16-31-17-15-28)29-20(2)26(24-11-5-6-13-25(24)29)27(30)23-12-7-9-21-8-3-4-10-22(21)23/h3-13,19H,14-18H2,1-2H3
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n/an/a 13n/an/an/an/an/an/a



Sanofi Research Division

Curated by ChEMBL


Assay Description
Concentration of compound required to inhibit 50% of [3H]-WIN- 55212 binding to Cannabinoid receptor 1 in rat cerebellum membranes.


J Med Chem 38: 3094-105 (1995)


Article DOI: 10.1021/jm00016a013
BindingDB Entry DOI: 10.7270/Q2DN442Z
More data for this
Ligand-Target Pair
Cannabinoid receptor


(Rattus norvegicus (rat))
BDBM50032555
PNG
(4-[2-Methyl-1-(2-morpholin-4-yl-ethyl)-1H-indole-3...)
Show SMILES Cc1c(C(=O)c2ccc(C#N)c3ccccc23)c2ccccc2n1CCN1CCOCC1
Show InChI InChI=1S/C27H25N3O2/c1-19-26(27(31)23-11-10-20(18-28)21-6-2-3-7-22(21)23)24-8-4-5-9-25(24)30(19)13-12-29-14-16-32-17-15-29/h2-11H,12-17H2,1H3
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n/an/a 15n/an/an/an/an/an/a



Sanofi Research Division

Curated by ChEMBL


Assay Description
Concentration of compound required to inhibit 50% of [3H]-WIN- 55212 binding to Cannabinoid receptor 1 in rat cerebellum membranes.


J Med Chem 38: 3094-105 (1995)


Article DOI: 10.1021/jm00016a013
BindingDB Entry DOI: 10.7270/Q2DN442Z
More data for this
Ligand-Target Pair
Cannabinoid receptor


(Rattus norvegicus (rat))
BDBM50032567
PNG
(Benzofuran-7-yl-[1-(2-morpholin-4-yl-ethyl)-1H-ind...)
Show SMILES O=C(c1cn(CCN2CCOCC2)c2ccccc12)c1cccc2ccoc12
Show InChI InChI=1S/C23H22N2O3/c26-22(19-6-3-4-17-8-13-28-23(17)19)20-16-25(21-7-2-1-5-18(20)21)10-9-24-11-14-27-15-12-24/h1-8,13,16H,9-12,14-15H2
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n/an/a 18n/an/an/an/an/an/a



Sanofi Research Division

Curated by ChEMBL


Assay Description
Concentration of compound required to inhibit 50% of [3H]-WIN- 55212 binding to Cannabinoid receptor 1 in rat cerebellum membranes.


J Med Chem 38: 3094-105 (1995)


Article DOI: 10.1021/jm00016a013
BindingDB Entry DOI: 10.7270/Q2DN442Z
More data for this
Ligand-Target Pair
Cannabinoid receptor


(Rattus norvegicus (rat))
BDBM50009864
PNG
(CHEMBL274833 | [2-Methyl-1-(2-morpholin-4-yl-ethyl...)
Show SMILES Cc1c(C(=O)c2cccc3ccccc23)c2ccccc2n1CCN1CCOCC1
Show InChI InChI=1S/C26H26N2O2/c1-19-25(26(29)22-11-6-8-20-7-2-3-9-21(20)22)23-10-4-5-12-24(23)28(19)14-13-27-15-17-30-18-16-27/h2-12H,13-18H2,1H3
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n/an/a 19n/an/an/an/an/an/a



Sanofi Research Division

Curated by ChEMBL


Assay Description
Concentration of compound required to inhibit 50% of [3H]-WIN- 55212 binding to Cannabinoid receptor 1 in rat cerebellum membranes.


J Med Chem 38: 3094-105 (1995)


Article DOI: 10.1021/jm00016a013
BindingDB Entry DOI: 10.7270/Q2DN442Z
More data for this
Ligand-Target Pair
Cannabinoid receptor


(Rattus norvegicus (rat))
BDBM50032562
PNG
(Benzofuran-4-yl-[1-(2-morpholin-4-yl-ethyl)-1H-ind...)
Show SMILES O=C(c1cn(CCN2CCOCC2)c2ccccc12)c1cccc2occc12
Show InChI InChI=1S/C23H22N2O3/c26-23(19-5-3-7-22-18(19)8-13-28-22)20-16-25(21-6-2-1-4-17(20)21)10-9-24-11-14-27-15-12-24/h1-8,13,16H,9-12,14-15H2
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n/an/a 24n/an/an/an/an/an/a



Sanofi Research Division

Curated by ChEMBL


Assay Description
Concentration of compound required to inhibit 50% of [3H]-WIN- 55212 binding to Cannabinoid receptor 1 in rat cerebellum membranes.


J Med Chem 38: 3094-105 (1995)


Article DOI: 10.1021/jm00016a013
BindingDB Entry DOI: 10.7270/Q2DN442Z
More data for this
Ligand-Target Pair
Cannabinoid receptor


(Rattus norvegicus (rat))
BDBM50032613
PNG
(CHEMBL78308 | [5-Fluoro-1-(2-morpholin-4-yl-ethyl)...)
Show SMILES Fc1ccc2n(CCN3CCOCC3)cc(C(=O)c3cccc4ccccc34)c2c1
Show InChI InChI=1S/C25H23FN2O2/c26-19-8-9-24-22(16-19)23(17-28(24)11-10-27-12-14-30-15-13-27)25(29)21-7-3-5-18-4-1-2-6-20(18)21/h1-9,16-17H,10-15H2
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n/an/a 35n/an/an/an/an/an/a



Sanofi Research Division

Curated by ChEMBL


Assay Description
Concentration of compound required to inhibit 50% of [3H]-WIN- 55212 binding to Cannabinoid receptor 1 in rat cerebellum membranes.


J Med Chem 38: 3094-105 (1995)


Article DOI: 10.1021/jm00016a013
BindingDB Entry DOI: 10.7270/Q2DN442Z
More data for this
Ligand-Target Pair
Cannabinoid receptor


(Rattus norvegicus (rat))
BDBM50032596
PNG
(CHEMBL311645 | [2-Methyl-1-(2-piperidin-1-yl-ethyl...)
Show SMILES Cc1c(C(=O)c2cccc3ccccc23)c2ccccc2n1CCN1CCCCC1
Show InChI InChI=1S/C27H28N2O/c1-20-26(27(30)23-14-9-11-21-10-3-4-12-22(21)23)24-13-5-6-15-25(24)29(20)19-18-28-16-7-2-8-17-28/h3-6,9-15H,2,7-8,16-19H2,1H3
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n/an/a 37n/an/an/an/an/an/a



Sanofi Research Division

Curated by ChEMBL


Assay Description
Concentration of compound required to inhibit 50% of [3H]-WIN- 55212 binding to Cannabinoid receptor 1 in rat cerebellum membranes.


J Med Chem 38: 3094-105 (1995)


Article DOI: 10.1021/jm00016a013
BindingDB Entry DOI: 10.7270/Q2DN442Z
More data for this
Ligand-Target Pair
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