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Compile Data Set for Download or QSAR

Found 32 hits with Last Name = 'blum' and Initial = 'g'   
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
Cathepsin B


(Rattus norvegicus)
BDBM36331
PNG
(Ac-YFR-AMOK 10b)
Show SMILES [#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#6]-[#8]-[#6](=O)-c1c(-[#6])cccc1-[#6]
Show InChI InChI=1S/C36H44N6O7/c1-22-9-7-10-23(2)32(22)35(48)49-21-31(45)28(13-8-18-39-36(37)38)41-34(47)30(19-25-11-5-4-6-12-25)42-33(46)29(40-24(3)43)20-26-14-16-27(44)17-15-26/h4-7,9-12,14-17,28-30,44H,8,13,18-21H2,1-3H3,(H,40,43)(H,41,47)(H,42,46)(H4,37,38,39)/t28-,29-,30-/m0/s1
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n/an/a 7.30n/an/an/an/a5.537



Stanford University



Assay Description
Protease enzyme inhibition assay targeting diverse member of the cysteine protease families:cathepsin B, Z, and H


Nat Chem Biol 1: 33-8 (2005)


Article DOI: 10.1038/nchembio707
BindingDB Entry DOI: 10.7270/Q22V2DGV
More data for this
Ligand-Target Pair
Cathepsin B


(Rattus norvegicus)
BDBM36328
PNG
(Z-FR-AMOK 9b)
Show SMILES [#6]-c1cccc(-[#6])c1-[#6](=O)-[#8]-[#6]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccccc1)-[#7]-[#6](=O)-[#8]-[#6]-c1ccccc1
Show InChI InChI=1S/C33H39N5O6/c1-22-11-9-12-23(2)29(22)31(41)43-21-28(39)26(17-10-18-36-32(34)35)37-30(40)27(19-24-13-5-3-6-14-24)38-33(42)44-20-25-15-7-4-8-16-25/h3-9,11-16,26-27H,10,17-21H2,1-2H3,(H,37,40)(H,38,42)(H4,34,35,36)/t26-,27-/m0/s1
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n/an/a 15n/an/an/an/a5.537



Stanford University



Assay Description
Protease enzyme inhibition assay targeting diverse member of the cysteine protease families:cathepsin B, Z, and H


Nat Chem Biol 1: 33-8 (2005)


Article DOI: 10.1038/nchembio707
BindingDB Entry DOI: 10.7270/Q22V2DGV
More data for this
Ligand-Target Pair
Cathepsin B


(Rattus norvegicus)
BDBM36327
PNG
(Z-FG-AOMK 9a)
Show SMILES Cc1cccc(C)c1C(=O)OCC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)OCc1ccccc1
Show InChI InChI=1S/C29H30N2O6/c1-20-10-9-11-21(2)26(20)28(34)36-19-24(32)17-30-27(33)25(16-22-12-5-3-6-13-22)31-29(35)37-18-23-14-7-4-8-15-23/h3-15,25H,16-19H2,1-2H3,(H,30,33)(H,31,35)
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n/an/a 120n/an/an/an/a5.537



Stanford University



Assay Description
Protease enzyme inhibition assay targeting diverse member of the cysteine protease families:cathepsin B, Z, and H


Nat Chem Biol 1: 33-8 (2005)


Article DOI: 10.1038/nchembio707
BindingDB Entry DOI: 10.7270/Q22V2DGV
More data for this
Ligand-Target Pair
Insulin-like growth factor I receptor


(Homo sapiens (Human))
BDBM50296357
PNG
(4,4'-(benzo[d][1,3]dioxol-5-ylazanediyl)bis(methyl...)
Show SMILES Oc1ccc(CN(Cc2ccc(O)c(O)c2)c2ccc3OCOc3c2)cc1O
Show InChI InChI=1S/C21H19NO6/c23-16-4-1-13(7-18(16)25)10-22(11-14-2-5-17(24)19(26)8-14)15-3-6-20-21(9-15)28-12-27-20/h1-9,23-26H,10-12H2
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n/an/a 170n/an/an/an/an/an/a



The Hebrew University of Jerusalem

Curated by ChEMBL


Assay Description
Inhibition of human IGF1R-mediated Poly Glu4Tyr phosphorylation by ELISA


Eur J Pharmacol 562: 1-11 (2007)


Article DOI: 10.1016/j.ejphar.2007.01.052
BindingDB Entry DOI: 10.7270/Q2VD6ZPB
More data for this
Ligand-Target Pair
Insulin-like growth factor I receptor


(Homo sapiens (Human))
BDBM50326005
PNG
(4,4'-(1H-indazol-6-ylazanediyl)bis(methylene)diben...)
Show SMILES Oc1ccc(CN(Cc2ccc(O)c(O)c2)c2ccc3cn[nH]c3c2)cc1O
Show InChI InChI=1S/C21H19N3O4/c25-18-5-1-13(7-20(18)27)11-24(12-14-2-6-19(26)21(28)8-14)16-4-3-15-10-22-23-17(15)9-16/h1-10,25-28H,11-12H2,(H,22,23)
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The Hebrew University of Jerusalem

Curated by ChEMBL


Assay Description
Inhibition of human IGF1R-mediated Poly Glu4Tyr phosphorylation by ELISA


Eur J Pharmacol 562: 1-11 (2007)


Article DOI: 10.1016/j.ejphar.2007.01.052
BindingDB Entry DOI: 10.7270/Q2VD6ZPB
More data for this
Ligand-Target Pair
Cathepsin B


(Rattus norvegicus)
BDBM36330
PNG
(AC-YFG-AMOK 10a)
Show SMILES CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)COC(=O)c1c(C)cccc1C
Show InChI InChI=1S/C32H35N3O7/c1-20-8-7-9-21(2)29(20)32(41)42-19-26(38)18-33-30(39)27(16-23-10-5-4-6-11-23)35-31(40)28(34-22(3)36)17-24-12-14-25(37)15-13-24/h4-15,27-28,37H,16-19H2,1-3H3,(H,33,39)(H,34,36)(H,35,40)/t27-,28-/m0/s1
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n/an/a 220n/an/an/an/a5.537



Stanford University



Assay Description
Protease enzyme inhibition assay targeting diverse member of the cysteine protease families:cathepsin B, Z, and H


Nat Chem Biol 1: 33-8 (2005)


Article DOI: 10.1038/nchembio707
BindingDB Entry DOI: 10.7270/Q22V2DGV
More data for this
Ligand-Target Pair
Insulin receptor


(Homo sapiens (Human))
BDBM50326005
PNG
(4,4'-(1H-indazol-6-ylazanediyl)bis(methylene)diben...)
Show SMILES Oc1ccc(CN(Cc2ccc(O)c(O)c2)c2ccc3cn[nH]c3c2)cc1O
Show InChI InChI=1S/C21H19N3O4/c25-18-5-1-13(7-20(18)27)11-24(12-14-2-6-19(26)21(28)8-14)16-4-3-15-10-22-23-17(15)9-16/h1-10,25-28H,11-12H2,(H,22,23)
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The Hebrew University of Jerusalem

Curated by ChEMBL


Assay Description
Inhibition of human insulin receptor-mediated Poly Glu4Tyr phosphorylation by ELISA


Eur J Pharmacol 562: 1-11 (2007)


Article DOI: 10.1016/j.ejphar.2007.01.052
BindingDB Entry DOI: 10.7270/Q2VD6ZPB
More data for this
Ligand-Target Pair
Insulin receptor


(Homo sapiens (Human))
BDBM50296357
PNG
(4,4'-(benzo[d][1,3]dioxol-5-ylazanediyl)bis(methyl...)
Show SMILES Oc1ccc(CN(Cc2ccc(O)c(O)c2)c2ccc3OCOc3c2)cc1O
Show InChI InChI=1S/C21H19NO6/c23-16-4-1-13(7-18(16)25)10-22(11-14-2-5-17(24)19(26)8-14)15-3-6-20-21(9-15)28-12-27-20/h1-9,23-26H,10-12H2
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The Hebrew University of Jerusalem

Curated by ChEMBL


Assay Description
Inhibition of human insulin receptor-mediated Poly Glu4Tyr phosphorylation by ELISA


Eur J Pharmacol 562: 1-11 (2007)


Article DOI: 10.1016/j.ejphar.2007.01.052
BindingDB Entry DOI: 10.7270/Q2VD6ZPB
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50296357
PNG
(4,4'-(benzo[d][1,3]dioxol-5-ylazanediyl)bis(methyl...)
Show SMILES Oc1ccc(CN(Cc2ccc(O)c(O)c2)c2ccc3OCOc3c2)cc1O
Show InChI InChI=1S/C21H19NO6/c23-16-4-1-13(7-18(16)25)10-22(11-14-2-5-17(24)19(26)8-14)15-3-6-20-21(9-15)28-12-27-20/h1-9,23-26H,10-12H2
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n/an/a 830n/an/an/an/an/an/a



The Hebrew University of Jerusalem

Curated by ChEMBL


Assay Description
Inhibition of human GST-fused Src-mediated Poly Glu4Tyr phosphorylation by ELISA


Eur J Pharmacol 562: 1-11 (2007)


Article DOI: 10.1016/j.ejphar.2007.01.052
BindingDB Entry DOI: 10.7270/Q2VD6ZPB
More data for this
Ligand-Target Pair
Cathepsin B


(Rattus norvegicus)
BDBM36329
PNG
(Z-LG-AOMK 9c)
Show SMILES CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)NCC(=O)COC(=O)c1c(C)cccc1C
Show InChI InChI=1S/C26H32N2O6/c1-17(2)13-22(28-26(32)34-15-20-11-6-5-7-12-20)24(30)27-14-21(29)16-33-25(31)23-18(3)9-8-10-19(23)4/h5-12,17,22H,13-16H2,1-4H3,(H,27,30)(H,28,32)/t22-/m0/s1
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n/an/a 920n/an/an/an/a5.537



Stanford University



Assay Description
Protease enzyme inhibition assay targeting diverse member of the cysteine protease families:cathepsin B, Z, and H


Nat Chem Biol 1: 33-8 (2005)


Article DOI: 10.1038/nchembio707
BindingDB Entry DOI: 10.7270/Q22V2DGV
More data for this
Ligand-Target Pair
Cathepsin B


(Rattus norvegicus)
BDBM36325
PNG
(Cathepsin Inhibitor III)
Show SMILES COc1ccc(cc1)C(=O)ONC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)OCc1ccccc1
Show InChI InChI=1S/C27H27N3O7/c1-35-22-14-12-21(13-15-22)26(33)37-30-24(31)17-28-25(32)23(16-19-8-4-2-5-9-19)29-27(34)36-18-20-10-6-3-7-11-20/h2-15,23H,16-18H2,1H3,(H,28,32)(H,29,34)(H,30,31)
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n/an/a 1.20E+3n/an/an/an/a5.537



Stanford University



Assay Description
Protease enzyme inhibition assay targeting diverse member of the cysteine protease families:cathepsin B, Z, and H


Nat Chem Biol 1: 33-8 (2005)


Article DOI: 10.1038/nchembio707
BindingDB Entry DOI: 10.7270/Q22V2DGV
More data for this
Ligand-Target Pair
Insulin-like growth factor I receptor


(Homo sapiens (Human))
BDBM50326008
PNG
(4-((7,7a-dihydrobenzo[d][1,3]dioxol-5-ylamino)meth...)
Show SMILES CC(=O)Oc1ccc(CNc2ccc3OCOc3c2)cc1OC(C)=O
Show InChI InChI=1S/C18H17NO6/c1-11(20)24-16-5-3-13(7-18(16)25-12(2)21)9-19-14-4-6-15-17(8-14)23-10-22-15/h3-8,19H,9-10H2,1-2H3
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n/an/a 1.30E+3n/an/an/an/an/an/a



The Hebrew University of Jerusalem

Curated by ChEMBL


Assay Description
Inhibition of human IGF1R-mediated Poly Glu4Tyr phosphorylation by ELISA


Eur J Pharmacol 562: 1-11 (2007)


Article DOI: 10.1016/j.ejphar.2007.01.052
BindingDB Entry DOI: 10.7270/Q2VD6ZPB
More data for this
Ligand-Target Pair
Cathepsin Z


(Rattus norvegicus)
BDBM36325
PNG
(Cathepsin Inhibitor III)
Show SMILES COc1ccc(cc1)C(=O)ONC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)OCc1ccccc1
Show InChI InChI=1S/C27H27N3O7/c1-35-22-14-12-21(13-15-22)26(33)37-30-24(31)17-28-25(32)23(16-19-8-4-2-5-9-19)29-27(34)36-18-20-10-6-3-7-11-20/h2-15,23H,16-18H2,1H3,(H,28,32)(H,29,34)(H,30,31)
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n/an/a 1.50E+3n/an/an/an/a5.537



Stanford University



Assay Description
Protease enzyme inhibition assay targeting diverse member of the cysteine protease families:cathepsin B, Z, and H


Nat Chem Biol 1: 33-8 (2005)


Article DOI: 10.1038/nchembio707
BindingDB Entry DOI: 10.7270/Q22V2DGV
More data for this
Ligand-Target Pair
Insulin-like growth factor I receptor


(Homo sapiens (Human))
BDBM50326004
PNG
(4-((1H-indazol-6-ylamino)methyl)benzene-1,2-diol |...)
Show SMILES Oc1ccc(CNc2ccc3cn[nH]c3c2)cc1O
Show InChI InChI=1S/C14H13N3O2/c18-13-4-1-9(5-14(13)19)7-15-11-3-2-10-8-16-17-12(10)6-11/h1-6,8,15,18-19H,7H2,(H,16,17)
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The Hebrew University of Jerusalem

Curated by ChEMBL


Assay Description
Inhibition of human IGF1R-mediated Poly Glu4Tyr phosphorylation by ELISA


Eur J Pharmacol 562: 1-11 (2007)


Article DOI: 10.1016/j.ejphar.2007.01.052
BindingDB Entry DOI: 10.7270/Q2VD6ZPB
More data for this
Ligand-Target Pair
Insulin receptor


(Homo sapiens (Human))
BDBM50326007
PNG
(4,4'-(naphthalen-2-ylazanediyl)bis(methylene)diben...)
Show SMILES Oc1ccc(CN(Cc2ccc(O)c(O)c2)c2ccc3ccccc3c2)cc1O
Show InChI InChI=1S/C24H21NO4/c26-21-9-5-16(11-23(21)28)14-25(15-17-6-10-22(27)24(29)12-17)20-8-7-18-3-1-2-4-19(18)13-20/h1-13,26-29H,14-15H2
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n/an/a 1.60E+3n/an/an/an/an/an/a



The Hebrew University of Jerusalem

Curated by ChEMBL


Assay Description
Inhibition of human insulin receptor-mediated Poly Glu4Tyr phosphorylation by ELISA


Eur J Pharmacol 562: 1-11 (2007)


Article DOI: 10.1016/j.ejphar.2007.01.052
BindingDB Entry DOI: 10.7270/Q2VD6ZPB
More data for this
Ligand-Target Pair
Insulin-like growth factor I receptor


(Homo sapiens (Human))
BDBM50326003
PNG
(4-((benzo[d][1,3]dioxol-5-ylamino)methyl)benzene-1...)
Show SMILES Oc1ccc(CNc2ccc3OCOc3c2)cc1O
Show InChI InChI=1S/C14H13NO4/c16-11-3-1-9(5-12(11)17)7-15-10-2-4-13-14(6-10)19-8-18-13/h1-6,15-17H,7-8H2
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n/an/a 1.69E+3n/an/an/an/an/an/a



The Hebrew University of Jerusalem

Curated by ChEMBL


Assay Description
Inhibition of human IGF1R-mediated Poly Glu4Tyr phosphorylation by ELISA


Eur J Pharmacol 562: 1-11 (2007)


Article DOI: 10.1016/j.ejphar.2007.01.052
BindingDB Entry DOI: 10.7270/Q2VD6ZPB
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50326003
PNG
(4-((benzo[d][1,3]dioxol-5-ylamino)methyl)benzene-1...)
Show SMILES Oc1ccc(CNc2ccc3OCOc3c2)cc1O
Show InChI InChI=1S/C14H13NO4/c16-11-3-1-9(5-12(11)17)7-15-10-2-4-13-14(6-10)19-8-18-13/h1-6,15-17H,7-8H2
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n/an/a 1.86E+3n/an/an/an/an/an/a



The Hebrew University of Jerusalem

Curated by ChEMBL


Assay Description
Inhibition of human GST-fused Src-mediated Poly Glu4Tyr phosphorylation by ELISA


Eur J Pharmacol 562: 1-11 (2007)


Article DOI: 10.1016/j.ejphar.2007.01.052
BindingDB Entry DOI: 10.7270/Q2VD6ZPB
More data for this
Ligand-Target Pair
Insulin receptor


(Homo sapiens (Human))
BDBM50326003
PNG
(4-((benzo[d][1,3]dioxol-5-ylamino)methyl)benzene-1...)
Show SMILES Oc1ccc(CNc2ccc3OCOc3c2)cc1O
Show InChI InChI=1S/C14H13NO4/c16-11-3-1-9(5-12(11)17)7-15-10-2-4-13-14(6-10)19-8-18-13/h1-6,15-17H,7-8H2
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n/an/a 2.08E+3n/an/an/an/an/an/a



The Hebrew University of Jerusalem

Curated by ChEMBL


Assay Description
Inhibition of human insulin receptor-mediated Poly Glu4Tyr phosphorylation by ELISA


Eur J Pharmacol 562: 1-11 (2007)


Article DOI: 10.1016/j.ejphar.2007.01.052
BindingDB Entry DOI: 10.7270/Q2VD6ZPB
More data for this
Ligand-Target Pair
Insulin receptor


(Homo sapiens (Human))
BDBM50326004
PNG
(4-((1H-indazol-6-ylamino)methyl)benzene-1,2-diol |...)
Show SMILES Oc1ccc(CNc2ccc3cn[nH]c3c2)cc1O
Show InChI InChI=1S/C14H13N3O2/c18-13-4-1-9(5-14(13)19)7-15-11-3-2-10-8-16-17-12(10)6-11/h1-6,8,15,18-19H,7H2,(H,16,17)
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The Hebrew University of Jerusalem

Curated by ChEMBL


Assay Description
Inhibition of human insulin receptor-mediated Poly Glu4Tyr phosphorylation by ELISA


Eur J Pharmacol 562: 1-11 (2007)


Article DOI: 10.1016/j.ejphar.2007.01.052
BindingDB Entry DOI: 10.7270/Q2VD6ZPB
More data for this
Ligand-Target Pair
Insulin-like growth factor I receptor


(Homo sapiens (Human))
BDBM50326007
PNG
(4,4'-(naphthalen-2-ylazanediyl)bis(methylene)diben...)
Show SMILES Oc1ccc(CN(Cc2ccc(O)c(O)c2)c2ccc3ccccc3c2)cc1O
Show InChI InChI=1S/C24H21NO4/c26-21-9-5-16(11-23(21)28)14-25(15-17-6-10-22(27)24(29)12-17)20-8-7-18-3-1-2-4-19(18)13-20/h1-13,26-29H,14-15H2
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n/an/a 2.45E+3n/an/an/an/an/an/a



The Hebrew University of Jerusalem

Curated by ChEMBL


Assay Description
Inhibition of human IGF1R-mediated Poly Glu4Tyr phosphorylation by ELISA


Eur J Pharmacol 562: 1-11 (2007)


Article DOI: 10.1016/j.ejphar.2007.01.052
BindingDB Entry DOI: 10.7270/Q2VD6ZPB
More data for this
Ligand-Target Pair
Insulin-like growth factor I receptor


(Homo sapiens (Human))
BDBM50296357
PNG
(4,4'-(benzo[d][1,3]dioxol-5-ylazanediyl)bis(methyl...)
Show SMILES Oc1ccc(CN(Cc2ccc(O)c(O)c2)c2ccc3OCOc3c2)cc1O
Show InChI InChI=1S/C21H19NO6/c23-16-4-1-13(7-18(16)25)10-22(11-14-2-5-17(24)19(26)8-14)15-3-6-20-21(9-15)28-12-27-20/h1-9,23-26H,10-12H2
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n/an/a 3.90E+3n/an/an/an/an/an/a



The Hebrew University of Jerusalem

Curated by ChEMBL


Assay Description
Inhibition of IGF1R-mediated colony formation in human LNCaP cells after 12 days by MTT assay


Eur J Pharmacol 562: 1-11 (2007)


Article DOI: 10.1016/j.ejphar.2007.01.052
BindingDB Entry DOI: 10.7270/Q2VD6ZPB
More data for this
Ligand-Target Pair
Insulin-like growth factor I receptor


(Homo sapiens (Human))
BDBM50326006
PNG
(4-((naphthalen-2-ylamino)methyl)benzene-1,2-diol |...)
Show SMILES Oc1ccc(CNc2ccc3ccccc3c2)cc1O
Show InChI InChI=1S/C17H15NO2/c19-16-8-5-12(9-17(16)20)11-18-15-7-6-13-3-1-2-4-14(13)10-15/h1-10,18-20H,11H2
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n/an/a 4.50E+3n/an/an/an/an/an/a



The Hebrew University of Jerusalem

Curated by ChEMBL


Assay Description
Inhibition of human IGF1R-mediated Poly Glu4Tyr phosphorylation by ELISA


Eur J Pharmacol 562: 1-11 (2007)


Article DOI: 10.1016/j.ejphar.2007.01.052
BindingDB Entry DOI: 10.7270/Q2VD6ZPB
More data for this
Ligand-Target Pair
Cathepsin Z


(Rattus norvegicus)
BDBM36331
PNG
(Ac-YFR-AMOK 10b)
Show SMILES [#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#6]-[#8]-[#6](=O)-c1c(-[#6])cccc1-[#6]
Show InChI InChI=1S/C36H44N6O7/c1-22-9-7-10-23(2)32(22)35(48)49-21-31(45)28(13-8-18-39-36(37)38)41-34(47)30(19-25-11-5-4-6-12-25)42-33(46)29(40-24(3)43)20-26-14-16-27(44)17-15-26/h4-7,9-12,14-17,28-30,44H,8,13,18-21H2,1-3H3,(H,40,43)(H,41,47)(H,42,46)(H4,37,38,39)/t28-,29-,30-/m0/s1
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n/an/a 4.70E+3n/an/an/an/a5.537



Stanford University



Assay Description
Protease enzyme inhibition assay targeting diverse member of the cysteine protease families:cathepsin B, Z, and H


Nat Chem Biol 1: 33-8 (2005)


Article DOI: 10.1038/nchembio707
BindingDB Entry DOI: 10.7270/Q22V2DGV
More data for this
Ligand-Target Pair
Insulin receptor


(Homo sapiens (Human))
BDBM50326006
PNG
(4-((naphthalen-2-ylamino)methyl)benzene-1,2-diol |...)
Show SMILES Oc1ccc(CNc2ccc3ccccc3c2)cc1O
Show InChI InChI=1S/C17H15NO2/c19-16-8-5-12(9-17(16)20)11-18-15-7-6-13-3-1-2-4-14(13)10-15/h1-10,18-20H,11H2
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n/an/a 5.15E+3n/an/an/an/an/an/a



The Hebrew University of Jerusalem

Curated by ChEMBL


Assay Description
Inhibition of human insulin receptor-mediated Poly Glu4Tyr phosphorylation by ELISA


Eur J Pharmacol 562: 1-11 (2007)


Article DOI: 10.1016/j.ejphar.2007.01.052
BindingDB Entry DOI: 10.7270/Q2VD6ZPB
More data for this
Ligand-Target Pair
Insulin-like growth factor I receptor


(Homo sapiens (Human))
BDBM50296357
PNG
(4,4'-(benzo[d][1,3]dioxol-5-ylazanediyl)bis(methyl...)
Show SMILES Oc1ccc(CN(Cc2ccc(O)c(O)c2)c2ccc3OCOc3c2)cc1O
Show InChI InChI=1S/C21H19NO6/c23-16-4-1-13(7-18(16)25)10-22(11-14-2-5-17(24)19(26)8-14)15-3-6-20-21(9-15)28-12-27-20/h1-9,23-26H,10-12H2
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n/an/a 5.30E+3n/an/an/an/an/an/a



The Hebrew University of Jerusalem

Curated by ChEMBL


Assay Description
Inhibition of IGF1R-mediated colony formation in human MCF7 cells after 12 days by MTT assay


Eur J Pharmacol 562: 1-11 (2007)


Article DOI: 10.1016/j.ejphar.2007.01.052
BindingDB Entry DOI: 10.7270/Q2VD6ZPB
More data for this
Ligand-Target Pair
Insulin-like growth factor I receptor


(Homo sapiens (Human))
BDBM50296357
PNG
(4,4'-(benzo[d][1,3]dioxol-5-ylazanediyl)bis(methyl...)
Show SMILES Oc1ccc(CN(Cc2ccc(O)c(O)c2)c2ccc3OCOc3c2)cc1O
Show InChI InChI=1S/C21H19NO6/c23-16-4-1-13(7-18(16)25)10-22(11-14-2-5-17(24)19(26)8-14)15-3-6-20-21(9-15)28-12-27-20/h1-9,23-26H,10-12H2
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n/an/a 6.20E+3n/an/an/an/an/an/a



The Hebrew University of Jerusalem

Curated by ChEMBL


Assay Description
Inhibition of IGF1R-mediated colony formation in human PC3 cells after 12 days by MTT assay


Eur J Pharmacol 562: 1-11 (2007)


Article DOI: 10.1016/j.ejphar.2007.01.052
BindingDB Entry DOI: 10.7270/Q2VD6ZPB
More data for this
Ligand-Target Pair
Cathepsin H


(Rattus norvegicus)
BDBM36325
PNG
(Cathepsin Inhibitor III)
Show SMILES COc1ccc(cc1)C(=O)ONC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)OCc1ccccc1
Show InChI InChI=1S/C27H27N3O7/c1-35-22-14-12-21(13-15-22)26(33)37-30-24(31)17-28-25(32)23(16-19-8-4-2-5-9-19)29-27(34)36-18-20-10-6-3-7-11-20/h2-15,23H,16-18H2,1H3,(H,28,32)(H,29,34)(H,30,31)
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n/an/a 6.60E+3n/an/an/an/a5.537



Stanford University



Assay Description
Protease enzyme inhibition assay targeting diverse member of the cysteine protease families:cathepsin B, Z, and H


Nat Chem Biol 1: 33-8 (2005)


Article DOI: 10.1038/nchembio707
BindingDB Entry DOI: 10.7270/Q22V2DGV
More data for this
Ligand-Target Pair
Cathepsin H


(Rattus norvegicus)
BDBM36329
PNG
(Z-LG-AOMK 9c)
Show SMILES CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)NCC(=O)COC(=O)c1c(C)cccc1C
Show InChI InChI=1S/C26H32N2O6/c1-17(2)13-22(28-26(32)34-15-20-11-6-5-7-12-20)24(30)27-14-21(29)16-33-25(31)23-18(3)9-8-10-19(23)4/h5-12,17,22H,13-16H2,1-4H3,(H,27,30)(H,28,32)/t22-/m0/s1
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n/an/a 7.90E+3n/an/an/an/a5.537



Stanford University



Assay Description
Protease enzyme inhibition assay targeting diverse member of the cysteine protease families:cathepsin B, Z, and H


Nat Chem Biol 1: 33-8 (2005)


Article DOI: 10.1038/nchembio707
BindingDB Entry DOI: 10.7270/Q22V2DGV
More data for this
Ligand-Target Pair
Cathepsin H


(Rattus norvegicus)
BDBM36330
PNG
(AC-YFG-AMOK 10a)
Show SMILES CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)COC(=O)c1c(C)cccc1C
Show InChI InChI=1S/C32H35N3O7/c1-20-8-7-9-21(2)29(20)32(41)42-19-26(38)18-33-30(39)27(16-23-10-5-4-6-11-23)35-31(40)28(34-22(3)36)17-24-12-14-25(37)15-13-24/h4-15,27-28,37H,16-19H2,1-3H3,(H,33,39)(H,34,36)(H,35,40)/t27-,28-/m0/s1
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n/an/a 7.90E+3n/an/an/an/a5.537



Stanford University



Assay Description
Protease enzyme inhibition assay targeting diverse member of the cysteine protease families:cathepsin B, Z, and H


Nat Chem Biol 1: 33-8 (2005)


Article DOI: 10.1038/nchembio707
BindingDB Entry DOI: 10.7270/Q22V2DGV
More data for this
Ligand-Target Pair
Insulin receptor


(Homo sapiens (Human))
BDBM50326008
PNG
(4-((7,7a-dihydrobenzo[d][1,3]dioxol-5-ylamino)meth...)
Show SMILES CC(=O)Oc1ccc(CNc2ccc3OCOc3c2)cc1OC(C)=O
Show InChI InChI=1S/C18H17NO6/c1-11(20)24-16-5-3-13(7-18(16)25-12(2)21)9-19-14-4-6-15-17(8-14)23-10-22-15/h3-8,19H,9-10H2,1-2H3
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n/an/a 9.90E+3n/an/an/an/an/an/a



The Hebrew University of Jerusalem

Curated by ChEMBL


Assay Description
Inhibition of human insulin receptor-mediated Poly Glu4Tyr phosphorylation by ELISA


Eur J Pharmacol 562: 1-11 (2007)


Article DOI: 10.1016/j.ejphar.2007.01.052
BindingDB Entry DOI: 10.7270/Q2VD6ZPB
More data for this
Ligand-Target Pair
Cathepsin H


(Rattus norvegicus)
BDBM36331
PNG
(Ac-YFR-AMOK 10b)
Show SMILES [#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#6]-[#8]-[#6](=O)-c1c(-[#6])cccc1-[#6]
Show InChI InChI=1S/C36H44N6O7/c1-22-9-7-10-23(2)32(22)35(48)49-21-31(45)28(13-8-18-39-36(37)38)41-34(47)30(19-25-11-5-4-6-12-25)42-33(46)29(40-24(3)43)20-26-14-16-27(44)17-15-26/h4-7,9-12,14-17,28-30,44H,8,13,18-21H2,1-3H3,(H,40,43)(H,41,47)(H,42,46)(H4,37,38,39)/t28-,29-,30-/m0/s1
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n/an/a 1.20E+4n/an/an/an/a5.537



Stanford University



Assay Description
Protease enzyme inhibition assay targeting diverse member of the cysteine protease families:cathepsin B, Z, and H


Nat Chem Biol 1: 33-8 (2005)


Article DOI: 10.1038/nchembio707
BindingDB Entry DOI: 10.7270/Q22V2DGV
More data for this
Ligand-Target Pair
Cathepsin Z


(Rattus norvegicus)
BDBM36330
PNG
(AC-YFG-AMOK 10a)
Show SMILES CC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)COC(=O)c1c(C)cccc1C
Show InChI InChI=1S/C32H35N3O7/c1-20-8-7-9-21(2)29(20)32(41)42-19-26(38)18-33-30(39)27(16-23-10-5-4-6-11-23)35-31(40)28(34-22(3)36)17-24-12-14-25(37)15-13-24/h4-15,27-28,37H,16-19H2,1-3H3,(H,33,39)(H,34,36)(H,35,40)/t27-,28-/m0/s1
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n/an/a 3.90E+4n/an/an/an/a5.537



Stanford University



Assay Description
Protease enzyme inhibition assay targeting diverse member of the cysteine protease families:cathepsin B, Z, and H


Nat Chem Biol 1: 33-8 (2005)


Article DOI: 10.1038/nchembio707
BindingDB Entry DOI: 10.7270/Q22V2DGV
More data for this
Ligand-Target Pair