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Compile Data Set for Download or QSAR

Found 157 hits with Last Name = 'reddy' and Initial = 'ds'   
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
Beta-secretase 1


(Homo sapiens (Human))
BDBM50231938
PNG
((2,5-dimethyloxazol-4-yl)methyl (R)-1-((4S,5S,7R)-...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CS(C)(=O)=O)NC(=O)OCc1nc(C)oc1C)[C@@H](O)C[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)NC(C)(C)C
Show InChI InChI=1S/C30H53N5O9S/c1-16(2)12-21(24(36)13-18(5)26(37)34-25(17(3)4)28(39)35-30(8,9)10)32-27(38)23(15-45(11,41)42)33-29(40)43-14-22-19(6)44-20(7)31-22/h16-18,21,23-25,36H,12-15H2,1-11H3,(H,32,38)(H,33,40)(H,34,37)(H,35,39)/t18-,21+,23+,24+,25+/m1/s1
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0.120n/an/an/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Binding affinity to recombinant memapsin 2


Bioorg Med Chem Lett 18: 1031-6 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.028
BindingDB Entry DOI: 10.7270/Q2513XZC
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Cavia porcellus (Guinea pig))
BDBM50462123
PNG
(CHEMBL4250984)
Show SMILES [#6]-[#6](-[#6])-[#6]-[#6]-[#7]-1-[#6]-[#6][Si;v4]2([#6]-[#6]-[#6]-c3ccccc23)[#6]-[#6]-1
Show InChI InChI=1S/C18H29NSi/c1-16(2)9-10-19-11-14-20(15-12-19)13-5-7-17-6-3-4-8-18(17)20/h3-4,6,8,16H,5,7,9-15H2,1-2H3
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0.300n/an/an/an/an/an/an/an/a



CSIR-National Chemical Laboratory

Curated by ChEMBL


Assay Description
Displacement of [3H]-(+)pentazocine from sigma-1 receptor in guinea pig brain membranes after 180 mins by scintillation counting method


J Med Chem 61: 3779-3798 (2018)


Article DOI: 10.1021/acs.jmedchem.7b00718
BindingDB Entry DOI: 10.7270/Q2GT5QTK
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [489-587,G537V,H558K,V571A]


(Human immunodeficiency virus)
BDBM50422052
PNG
(CHEMBL109952 | L-700417)
Show SMILES OC(C[C@@H](Cc1ccccc1)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12)C[C@@H](Cc1ccccc1)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12 |r|
Show InChI InChI=1S/C39H42N2O5/c42-31(21-29(19-25-11-3-1-4-12-25)38(45)40-36-32-17-9-7-15-27(32)23-34(36)43)22-30(20-26-13-5-2-6-14-26)39(46)41-37-33-18-10-8-16-28(33)24-35(37)44/h1-18,29-31,34-37,42-44H,19-24H2,(H,40,45)(H,41,46)/t29-,30-,34-,35-,36+,37+/m1/s1
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0.370n/an/an/an/an/an/an/an/a



CSIR-National Chemical Laboratory

Curated by ChEMBL


Assay Description
Inhibition of recombinant HIV protease expressed in inclusion bodies of Escherichia coli BL21 (DE3)


J Med Chem 61: 3779-3798 (2018)


Article DOI: 10.1021/acs.jmedchem.7b00718
BindingDB Entry DOI: 10.7270/Q2GT5QTK
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [489-587,G537V,H558K,V571A]


(Human immunodeficiency virus)
BDBM50067593
PNG
(CHEBI:44032 | Crixivan | Indinavir | L-735524 | MK...)
Show SMILES CC(C)(C)NC(=O)[C@@H]1CN(Cc2cccnc2)CCN1C[C@@H](O)C[C@@H](Cc1ccccc1)C(=O)N[C@@H]1[C@H](O)Cc2ccccc12 |r|
Show InChI InChI=1S/C36H47N5O4/c1-36(2,3)39-35(45)31-24-40(22-26-12-9-15-37-21-26)16-17-41(31)23-29(42)19-28(18-25-10-5-4-6-11-25)34(44)38-33-30-14-8-7-13-27(30)20-32(33)43/h4-15,21,28-29,31-33,42-43H,16-20,22-24H2,1-3H3,(H,38,44)(H,39,45)/t28-,29+,31+,32-,33+/m1/s1
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0.380n/an/an/an/an/an/an/an/a



CSIR-National Chemical Laboratory

Curated by ChEMBL


Assay Description
Inhibition of recombinant HIV protease expressed in inclusion bodies of Escherichia coli BL21 (DE3)


J Med Chem 61: 3779-3798 (2018)


Article DOI: 10.1021/acs.jmedchem.7b00718
BindingDB Entry DOI: 10.7270/Q2GT5QTK
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Sigma non-opioid intracellular receptor 1


(Cavia porcellus (Guinea pig))
BDBM50462118
PNG
(CHEMBL4243296)
Show SMILES [#6](-[#7]-1-[#6]-[#6][Si;v4]2([#6]-[#6]-[#6]-c3ccccc23)[#6]-[#6]-1)-c1ccccc1
Show InChI InChI=1S/C20H25NSi/c1-2-7-18(8-3-1)17-21-12-15-22(16-13-21)14-6-10-19-9-4-5-11-20(19)22/h1-5,7-9,11H,6,10,12-17H2
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1.10n/an/an/an/an/an/an/an/a



CSIR-National Chemical Laboratory

Curated by ChEMBL


Assay Description
Displacement of [3H]-(+)pentazocine from sigma-1 receptor in guinea pig brain membranes after 180 mins by scintillation counting method


J Med Chem 61: 3779-3798 (2018)


Article DOI: 10.1021/acs.jmedchem.7b00718
BindingDB Entry DOI: 10.7270/Q2GT5QTK
More data for this
Ligand-Target Pair
Beta-secretase 1


(Homo sapiens (Human))
BDBM16047
PNG
((4S)-4-[(2S)-2-[(2R,4S,5S)-5-[(2S)-2-[(2S)-2-[(4S)...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)CCC(O)=O)C(C)C)[C@@H](O)C[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O |r|
Show InChI InChI=1S/C41H64N8O14/c1-20(2)16-27(46-39(60)28(19-31(43)51)47-40(61)34(21(3)4)49-37(58)25(42)12-14-32(52)53)30(50)17-22(5)35(56)44-23(6)36(57)45-26(13-15-33(54)55)38(59)48-29(41(62)63)18-24-10-8-7-9-11-24/h7-11,20-23,25-30,34,50H,12-19,42H2,1-6H3,(H2,43,51)(H,44,56)(H,45,57)(H,46,60)(H,47,61)(H,48,59)(H,49,58)(H,52,53)(H,54,55)(H,62,63)/t22-,23+,25+,26+,27+,28+,29+,30+,34+/m1/s1
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1.60n/an/an/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Binding affinity to recombinant memapsin 2


Bioorg Med Chem Lett 18: 1031-6 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.028
BindingDB Entry DOI: 10.7270/Q2513XZC
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Beta-secretase 1


(Homo sapiens (Human))
BDBM50231937
PNG
(CHEMBL403268 | N-{(1S,2R)-1-benzyl-2-hydroxy-3-[(3...)
Show SMILES COc1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)c2cc(cc(c2)C(=O)N[C@H](C)c2ccccc2)N(C)S(C)(=O)=O)c1
Show InChI InChI=1S/C36H42N4O6S/c1-25(28-15-9-6-10-16-28)38-35(42)29-20-30(22-31(21-29)40(2)47(4,44)45)36(43)39-33(19-26-12-7-5-8-13-26)34(41)24-37-23-27-14-11-17-32(18-27)46-3/h5-18,20-22,25,33-34,37,41H,19,23-24H2,1-4H3,(H,38,42)(H,39,43)/t25-,33+,34-/m1/s1
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1.80n/an/an/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Binding affinity to recombinant memapsin 2


Bioorg Med Chem Lett 18: 1031-6 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.028
BindingDB Entry DOI: 10.7270/Q2513XZC
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Sigma non-opioid intracellular receptor 1


(Cavia porcellus (Guinea pig))
BDBM50462121
PNG
(CHEMBL4240868)
Show SMILES CC(C)CCN1CCC2(CCCc3ccccc23)CC1
Show InChI InChI=1S/C19H29N/c1-16(2)9-13-20-14-11-19(12-15-20)10-5-7-17-6-3-4-8-18(17)19/h3-4,6,8,16H,5,7,9-15H2,1-2H3
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1.80n/an/an/an/an/an/an/an/a



CSIR-National Chemical Laboratory

Curated by ChEMBL


Assay Description
Displacement of [3H]-(+)pentazocine from sigma-1 receptor in guinea pig brain membranes after 180 mins by scintillation counting method


J Med Chem 61: 3779-3798 (2018)


Article DOI: 10.1021/acs.jmedchem.7b00718
BindingDB Entry DOI: 10.7270/Q2GT5QTK
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Cavia porcellus (Guinea pig))
BDBM50035097
PNG
(1''-benzyl-3,4-dihydro-2H-spiro[naphthalene-1,4''-...)
Show SMILES C(N1CCC2(CCCc3ccccc23)CC1)c1ccccc1
Show InChI InChI=1S/C21H25N/c1-2-7-18(8-3-1)17-22-15-13-21(14-16-22)12-6-10-19-9-4-5-11-20(19)21/h1-5,7-9,11H,6,10,12-17H2
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2n/an/an/an/an/an/an/an/a



CSIR-National Chemical Laboratory

Curated by ChEMBL


Assay Description
Displacement of [3H]-(+)pentazocine from sigma-1 receptor in guinea pig brain membranes after 180 mins by scintillation counting method


J Med Chem 61: 3779-3798 (2018)


Article DOI: 10.1021/acs.jmedchem.7b00718
BindingDB Entry DOI: 10.7270/Q2GT5QTK
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Cavia porcellus (Guinea pig))
BDBM50462120
PNG
(CHEMBL4243361)
Show SMILES [#6]-[#8]-c1ccc(-[#6]-[#7]-2-[#6]-[#6][Si;v4]3([#6]-[#6]-[#6]-c4ccccc34)[#6]-[#6]-2)cc1
Show InChI InChI=1S/C21H27NOSi/c1-23-20-10-8-18(9-11-20)17-22-12-15-24(16-13-22)14-4-6-19-5-2-3-7-21(19)24/h2-3,5,7-11H,4,6,12-17H2,1H3
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2.70n/an/an/an/an/an/an/an/a



CSIR-National Chemical Laboratory

Curated by ChEMBL


Assay Description
Displacement of [3H]-(+)pentazocine from sigma-1 receptor in guinea pig brain membranes after 180 mins by scintillation counting method


J Med Chem 61: 3779-3798 (2018)


Article DOI: 10.1021/acs.jmedchem.7b00718
BindingDB Entry DOI: 10.7270/Q2GT5QTK
More data for this
Ligand-Target Pair
Gag-Pol polyprotein [489-587,G537V,H558K,V571A]


(Human immunodeficiency virus)
BDBM50462131
PNG
(CHEMBL2182010)
Show SMILES [#8]-[#6@@H]-1-[#6]-c2ccccc2-[#6@@H]-1-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccccc1)-[#6][Si;v4]([#8])([#8])[#6]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H]-1-[#6@H](-[#8])-[#6]-c2ccccc-12 |r|
Show InChI InChI=1S/C38H42N2O6Si/c41-33-21-27-15-7-9-17-31(27)35(33)39-37(43)29(19-25-11-3-1-4-12-25)23-47(45,46)24-30(20-26-13-5-2-6-14-26)38(44)40-36-32-18-10-8-16-28(32)22-34(36)42/h1-18,29-30,33-36,41-42,45-46H,19-24H2,(H,39,43)(H,40,44)/t29-,30-,33-,34-,35+,36+/m1/s1
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2.70n/an/an/an/an/an/an/an/a



CSIR-National Chemical Laboratory

Curated by ChEMBL


Assay Description
Inhibition of HIV protease


J Med Chem 61: 3779-3798 (2018)


Article DOI: 10.1021/acs.jmedchem.7b00718
BindingDB Entry DOI: 10.7270/Q2GT5QTK
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Cavia porcellus (Guinea pig))
BDBM50462119
PNG
(CHEMBL4247145)
Show SMILES [#6](-[#6]-c1ccccc1)-[#7]-1-[#6]-[#6][Si;v4]2([#6]-[#6]-[#6]-c3ccccc23)[#6]-[#6]-1
Show InChI InChI=1S/C21H27NSi/c1-2-7-19(8-3-1)12-13-22-14-17-23(18-15-22)16-6-10-20-9-4-5-11-21(20)23/h1-5,7-9,11H,6,10,12-18H2
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2.90n/an/an/an/an/an/an/an/a



CSIR-National Chemical Laboratory

Curated by ChEMBL


Assay Description
Displacement of [3H]-(+)pentazocine from sigma-1 receptor in guinea pig brain membranes after 180 mins by scintillation counting method


J Med Chem 61: 3779-3798 (2018)


Article DOI: 10.1021/acs.jmedchem.7b00718
BindingDB Entry DOI: 10.7270/Q2GT5QTK
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Cavia porcellus (Guinea pig))
BDBM50421951
PNG
(CHEMBL1744002)
Show SMILES COc1ccc(CN2CCC3(CCCc4ccccc34)CC2)cc1
Show InChI InChI=1S/C22H27NO/c1-24-20-10-8-18(9-11-20)17-23-15-13-22(14-16-23)12-4-6-19-5-2-3-7-21(19)22/h2-3,5,7-11H,4,6,12-17H2,1H3
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3.80n/an/an/an/an/an/an/an/a



CSIR-National Chemical Laboratory

Curated by ChEMBL


Assay Description
Displacement of [3H]-(+)pentazocine from sigma-1 receptor in guinea pig brain membranes after 180 mins by scintillation counting method


J Med Chem 61: 3779-3798 (2018)


Article DOI: 10.1021/acs.jmedchem.7b00718
BindingDB Entry DOI: 10.7270/Q2GT5QTK
More data for this
Ligand-Target Pair
Sigma intracellular receptor 2


(Rattus norvegicus (Rat))
BDBM50462121
PNG
(CHEMBL4240868)
Show SMILES CC(C)CCN1CCC2(CCCc3ccccc23)CC1
Show InChI InChI=1S/C19H29N/c1-16(2)9-13-20-14-11-19(12-15-20)10-5-7-17-6-3-4-8-18(17)19/h3-4,6,8,16H,5,7,9-15H2,1-2H3
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5.5n/an/an/an/an/an/an/an/a



CSIR-National Chemical Laboratory

Curated by ChEMBL


Assay Description
Displacement of [3H]-DTG from sigma-2 receptor in rat liver membranes after 180 mins by scintillation counting method


J Med Chem 61: 3779-3798 (2018)


Article DOI: 10.1021/acs.jmedchem.7b00718
BindingDB Entry DOI: 10.7270/Q2GT5QTK
More data for this
Ligand-Target Pair
Sigma non-opioid intracellular receptor 1


(Cavia porcellus (Guinea pig))
BDBM50421931
PNG
(CHEMBL1744009)
Show SMILES C(Cc1ccccc1)N1CCC2(CCCc3ccccc23)CC1
Show InChI InChI=1S/C22H27N/c1-2-7-19(8-3-1)12-16-23-17-14-22(15-18-23)13-6-10-20-9-4-5-11-21(20)22/h1-5,7-9,11H,6,10,12-18H2
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8n/an/an/an/an/an/an/an/a



CSIR-National Chemical Laboratory

Curated by ChEMBL


Assay Description
Displacement of [3H]-(+)pentazocine from sigma-1 receptor in guinea pig brain membranes after 180 mins by scintillation counting method


J Med Chem 61: 3779-3798 (2018)


Article DOI: 10.1021/acs.jmedchem.7b00718
BindingDB Entry DOI: 10.7270/Q2GT5QTK
More data for this
Ligand-Target Pair
Sigma intracellular receptor 2


(Rattus norvegicus (Rat))
BDBM50462123
PNG
(CHEMBL4250984)
Show SMILES [#6]-[#6](-[#6])-[#6]-[#6]-[#7]-1-[#6]-[#6][Si;v4]2([#6]-[#6]-[#6]-c3ccccc23)[#6]-[#6]-1
Show InChI InChI=1S/C18H29NSi/c1-16(2)9-10-19-11-14-20(15-12-19)13-5-7-17-6-3-4-8-18(17)20/h3-4,6,8,16H,5,7,9-15H2,1-2H3
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19n/an/an/an/an/an/an/an/a



CSIR-National Chemical Laboratory

Curated by ChEMBL


Assay Description
Displacement of [3H]-DTG from sigma-2 receptor in rat liver membranes after 180 mins by scintillation counting method


J Med Chem 61: 3779-3798 (2018)


Article DOI: 10.1021/acs.jmedchem.7b00718
BindingDB Entry DOI: 10.7270/Q2GT5QTK
More data for this
Ligand-Target Pair
Beta-secretase 1


(Homo sapiens (Human))
BDBM50231932
PNG
(CHEMBL253930 | N1-((2S,3R)-3-hydroxy-4-((1-(methyl...)
Show SMILES C[C@@H](NC(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1ccc2ccn(c2c1)S(C)(=O)=O)N(C)S(C)(=O)=O)c1ccccc1
Show InChI InChI=1S/C38H43N5O7S2/c1-26(29-13-9-6-10-14-29)40-37(45)31-21-32(23-33(22-31)42(2)51(3,47)48)38(46)41-34(19-27-11-7-5-8-12-27)36(44)25-39-24-28-15-16-30-17-18-43(35(30)20-28)52(4,49)50/h5-18,20-23,26,34,36,39,44H,19,24-25H2,1-4H3,(H,40,45)(H,41,46)/t26-,34+,36-/m1/s1
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27n/an/an/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Binding affinity to recombinant memapsin 2


Bioorg Med Chem Lett 18: 1031-6 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.028
BindingDB Entry DOI: 10.7270/Q2513XZC
More data for this
Ligand-Target Pair
Sigma intracellular receptor 2


(Rattus norvegicus (Rat))
BDBM50421931
PNG
(CHEMBL1744009)
Show SMILES C(Cc1ccccc1)N1CCC2(CCCc3ccccc23)CC1
Show InChI InChI=1S/C22H27N/c1-2-7-19(8-3-1)12-16-23-17-14-22(15-18-23)13-6-10-20-9-4-5-11-21(20)22/h1-5,7-9,11H,6,10,12-18H2
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34n/an/an/an/an/an/an/an/a



CSIR-National Chemical Laboratory

Curated by ChEMBL


Assay Description
Displacement of [3H]-DTG from sigma-2 receptor in rat liver membranes after 180 mins by scintillation counting method


J Med Chem 61: 3779-3798 (2018)


Article DOI: 10.1021/acs.jmedchem.7b00718
BindingDB Entry DOI: 10.7270/Q2GT5QTK
More data for this
Ligand-Target Pair
Sigma intracellular receptor 2


(Rattus norvegicus (Rat))
BDBM50462119
PNG
(CHEMBL4247145)
Show SMILES [#6](-[#6]-c1ccccc1)-[#7]-1-[#6]-[#6][Si;v4]2([#6]-[#6]-[#6]-c3ccccc23)[#6]-[#6]-1
Show InChI InChI=1S/C21H27NSi/c1-2-7-19(8-3-1)12-13-22-14-17-23(18-15-22)16-6-10-20-9-4-5-11-21(20)23/h1-5,7-9,11H,6,10,12-18H2
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39n/an/an/an/an/an/an/an/a



CSIR-National Chemical Laboratory

Curated by ChEMBL


Assay Description
Displacement of [3H]-DTG from sigma-2 receptor in rat liver membranes after 180 mins by scintillation counting method


J Med Chem 61: 3779-3798 (2018)


Article DOI: 10.1021/acs.jmedchem.7b00718
BindingDB Entry DOI: 10.7270/Q2GT5QTK
More data for this
Ligand-Target Pair
Sigma intracellular receptor 2


(Rattus norvegicus (Rat))
BDBM50035097
PNG
(1''-benzyl-3,4-dihydro-2H-spiro[naphthalene-1,4''-...)
Show SMILES C(N1CCC2(CCCc3ccccc23)CC1)c1ccccc1
Show InChI InChI=1S/C21H25N/c1-2-7-18(8-3-1)17-22-15-13-21(14-16-22)12-6-10-19-9-4-5-11-20(19)21/h1-5,7-9,11H,6,10,12-17H2
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44n/an/an/an/an/an/an/an/a



CSIR-National Chemical Laboratory

Curated by ChEMBL


Assay Description
Displacement of [3H]-DTG from sigma-2 receptor in rat liver membranes after 180 mins by scintillation counting method


J Med Chem 61: 3779-3798 (2018)


Article DOI: 10.1021/acs.jmedchem.7b00718
BindingDB Entry DOI: 10.7270/Q2GT5QTK
More data for this
Ligand-Target Pair
Chymotrypsinogen A


(Bos taurus (bovine))
BDBM50462115
PNG
(CHEMBL2311598)
Show SMILES [#6]-[#6@H](-[#6][Si;v4]([#8])([#8])[#6@H](-[#6]-c1ccccc1)-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1)-[#6](-[#7])=O |r|
Show InChI InChI=1S/C17H27N3O4Si/c1-12(16(18)21)11-25(23,24)15(10-13-6-3-2-4-7-13)20-17(22)14-8-5-9-19-14/h2-4,6-7,12,14-15,19,23-24H,5,8-11H2,1H3,(H2,18,21)(H,20,22)/t12-,14+,15-/m1/s1
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107n/an/an/an/an/an/an/an/a



CSIR-National Chemical Laboratory

Curated by ChEMBL


Assay Description
Inhibition of bovine alpha-chymotrypsin using succinyl Ala-Ala-Pro-Phe-p-nitroanilide as substrate after 1 hr by Dixon plot analysis


J Med Chem 61: 3779-3798 (2018)


Article DOI: 10.1021/acs.jmedchem.7b00718
BindingDB Entry DOI: 10.7270/Q2GT5QTK
More data for this
Ligand-Target Pair
Sigma intracellular receptor 2


(Rattus norvegicus (Rat))
BDBM50421951
PNG
(CHEMBL1744002)
Show SMILES COc1ccc(CN2CCC3(CCCc4ccccc34)CC2)cc1
Show InChI InChI=1S/C22H27NO/c1-24-20-10-8-18(9-11-20)17-23-15-13-22(14-16-23)12-4-6-19-5-2-3-7-21(19)22/h2-3,5,7-11H,4,6,12-17H2,1H3
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206n/an/an/an/an/an/an/an/a



CSIR-National Chemical Laboratory

Curated by ChEMBL


Assay Description
Displacement of [3H]-DTG from sigma-2 receptor in rat liver membranes after 180 mins by scintillation counting method


J Med Chem 61: 3779-3798 (2018)


Article DOI: 10.1021/acs.jmedchem.7b00718
BindingDB Entry DOI: 10.7270/Q2GT5QTK
More data for this
Ligand-Target Pair
Beta-secretase 1


(Homo sapiens (Human))
BDBM50231933
PNG
(CHEMBL253929 | N1-((2S,3R)-4-((1H-indol-6-yl)methy...)
Show SMILES C[C@@H](NC(=O)c1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNCc1ccc2cc[nH]c2c1)N(C)S(C)(=O)=O)c1ccccc1
Show InChI InChI=1S/C37H41N5O5S/c1-25(28-12-8-5-9-13-28)40-36(44)30-20-31(22-32(21-30)42(2)48(3,46)47)37(45)41-34(18-26-10-6-4-7-11-26)35(43)24-38-23-27-14-15-29-16-17-39-33(29)19-27/h4-17,19-22,25,34-35,38-39,43H,18,23-24H2,1-3H3,(H,40,44)(H,41,45)/t25-,34+,35-/m1/s1
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230n/an/an/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Binding affinity to recombinant memapsin 2


Bioorg Med Chem Lett 18: 1031-6 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.028
BindingDB Entry DOI: 10.7270/Q2513XZC
More data for this
Ligand-Target Pair
Sigma intracellular receptor 2


(Rattus norvegicus (Rat))
BDBM50462118
PNG
(CHEMBL4243296)
Show SMILES [#6](-[#7]-1-[#6]-[#6][Si;v4]2([#6]-[#6]-[#6]-c3ccccc23)[#6]-[#6]-1)-c1ccccc1
Show InChI InChI=1S/C20H25NSi/c1-2-7-18(8-3-1)17-21-12-15-22(16-13-21)14-6-10-19-9-4-5-11-20(19)22/h1-5,7-9,11H,6,10,12-17H2
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243n/an/an/an/an/an/an/an/a



CSIR-National Chemical Laboratory

Curated by ChEMBL


Assay Description
Displacement of [3H]-DTG from sigma-2 receptor in rat liver membranes after 180 mins by scintillation counting method


J Med Chem 61: 3779-3798 (2018)


Article DOI: 10.1021/acs.jmedchem.7b00718
BindingDB Entry DOI: 10.7270/Q2GT5QTK
More data for this
Ligand-Target Pair
Beta-secretase 1


(Homo sapiens (Human))
BDBM50231941
PNG
(CHEMBL253103 | N1-((2S,3R)-3-hydroxy-4-(isopropyla...)
Show SMILES CC(C)NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O
Show InChI InChI=1S/C31H40N4O5S/c1-21(2)32-20-29(36)28(16-23-12-8-6-9-13-23)34-31(38)26-17-25(18-27(19-26)35(4)41(5,39)40)30(37)33-22(3)24-14-10-7-11-15-24/h6-15,17-19,21-22,28-29,32,36H,16,20H2,1-5H3,(H,33,37)(H,34,38)/t22-,28+,29-/m1/s1
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425n/an/an/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Binding affinity to recombinant memapsin 2


Bioorg Med Chem Lett 18: 1031-6 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.028
BindingDB Entry DOI: 10.7270/Q2513XZC
More data for this
Ligand-Target Pair
Sigma intracellular receptor 2


(Rattus norvegicus (Rat))
BDBM50462120
PNG
(CHEMBL4243361)
Show SMILES [#6]-[#8]-c1ccc(-[#6]-[#7]-2-[#6]-[#6][Si;v4]3([#6]-[#6]-[#6]-c4ccccc34)[#6]-[#6]-2)cc1
Show InChI InChI=1S/C21H27NOSi/c1-23-20-10-8-18(9-11-20)17-22-12-15-24(16-13-22)14-4-6-19-5-2-3-7-21(19)24/h2-3,5,7-11H,4,6,12-17H2,1H3
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460n/an/an/an/an/an/an/an/a



CSIR-National Chemical Laboratory

Curated by ChEMBL


Assay Description
Displacement of [3H]-DTG from sigma-2 receptor in rat liver membranes after 180 mins by scintillation counting method


J Med Chem 61: 3779-3798 (2018)


Article DOI: 10.1021/acs.jmedchem.7b00718
BindingDB Entry DOI: 10.7270/Q2GT5QTK
More data for this
Ligand-Target Pair
Beta-secretase 1


(Homo sapiens (Human))
BDBM50231931
PNG
(CHEMBL403483 | N1-((2S,3R)-4-(3-methoxybenzylamino...)
Show SMILES COc1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)c2cc(cc(c2)C(=O)NCc2nc(C)oc2C)N(C)S(C)(=O)=O)c1
Show InChI InChI=1S/C34H41N5O7S/c1-22-31(37-23(2)46-22)20-36-33(41)26-16-27(18-28(17-26)39(3)47(5,43)44)34(42)38-30(15-24-10-7-6-8-11-24)32(40)21-35-19-25-12-9-13-29(14-25)45-4/h6-14,16-18,30,32,35,40H,15,19-21H2,1-5H3,(H,36,41)(H,38,42)/t30-,32+/m0/s1
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552n/an/an/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Binding affinity to recombinant memapsin 2


Bioorg Med Chem Lett 18: 1031-6 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.028
BindingDB Entry DOI: 10.7270/Q2513XZC
More data for this
Ligand-Target Pair
Beta-secretase 1


(Homo sapiens (Human))
BDBM50231940
PNG
(CHEMBL252276 | N1-((2S,3R)-3-hydroxy-4-((S)-1-(iso...)
Show SMILES CC(C)NC(=O)[C@@H](NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc(cc(c1)C(=O)N[C@H](C)c1ccccc1)N(C)S(C)(=O)=O)C(C)C
Show InChI InChI=1S/C36H49N5O6S/c1-23(2)33(36(45)38-24(3)4)37-22-32(42)31(18-26-14-10-8-11-15-26)40-35(44)29-19-28(20-30(21-29)41(6)48(7,46)47)34(43)39-25(5)27-16-12-9-13-17-27/h8-17,19-21,23-25,31-33,37,42H,18,22H2,1-7H3,(H,38,45)(H,39,43)(H,40,44)/t25-,31+,32-,33+/m1/s1
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564n/an/an/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Binding affinity to recombinant memapsin 2


Bioorg Med Chem Lett 18: 1031-6 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.028
BindingDB Entry DOI: 10.7270/Q2513XZC
More data for this
Ligand-Target Pair
Beta-secretase 1


(Homo sapiens (Human))
BDBM50231934
PNG
(CHEMBL403269 | N1-((2S,3R)-4-(3-methoxybenzylamino...)
Show SMILES COc1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)c2cc(cc(c2)C(=O)N[C@@H](C)c2ccccc2)N(C)S(C)(=O)=O)c1
Show InChI InChI=1S/C36H42N4O6S/c1-25(28-15-9-6-10-16-28)38-35(42)29-20-30(22-31(21-29)40(2)47(4,44)45)36(43)39-33(19-26-12-7-5-8-13-26)34(41)24-37-23-27-14-11-17-32(18-27)46-3/h5-18,20-22,25,33-34,37,41H,19,23-24H2,1-4H3,(H,38,42)(H,39,43)/t25-,33-,34+/m0/s1
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617n/an/an/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Binding affinity to recombinant memapsin 2


Bioorg Med Chem Lett 18: 1031-6 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.028
BindingDB Entry DOI: 10.7270/Q2513XZC
More data for this
Ligand-Target Pair
Beta-secretase 1


(Homo sapiens (Human))
BDBM50231939
PNG
(CHEMBL404144 | N1-((2S,3R)-4-(3-methoxybenzylamino...)
Show SMILES COc1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)c2cc(cc(c2)C(=O)NC(C)c2nc(C)oc2C)N(C)S(C)(=O)=O)c1 |w:32.34|
Show InChI InChI=1S/C35H43N5O7S/c1-22(33-23(2)47-24(3)38-33)37-34(42)27-17-28(19-29(18-27)40(4)48(6,44)45)35(43)39-31(16-25-11-8-7-9-12-25)32(41)21-36-20-26-13-10-14-30(15-26)46-5/h7-15,17-19,22,31-32,36,41H,16,20-21H2,1-6H3,(H,37,42)(H,39,43)/t22?,31-,32+/m0/s1
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894n/an/an/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Binding affinity to recombinant memapsin 2


Bioorg Med Chem Lett 18: 1031-6 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.028
BindingDB Entry DOI: 10.7270/Q2513XZC
More data for this
Ligand-Target Pair
Beta-secretase 1


(Homo sapiens (Human))
BDBM50231936
PNG
(CHEMBL253931 | N1-((2R,3S)-1-(3-methoxybenzylamino...)
Show SMILES COc1cccc(CNC[C@@H](O)[C@H](CC(C)C)NC(=O)c2cc(cc(c2)C(=O)N[C@H](C)c2ccccc2)N(C)S(C)(=O)=O)c1
Show InChI InChI=1S/C33H44N4O6S/c1-22(2)15-30(31(38)21-34-20-24-11-10-14-29(16-24)43-5)36-33(40)27-17-26(18-28(19-27)37(4)44(6,41)42)32(39)35-23(3)25-12-8-7-9-13-25/h7-14,16-19,22-23,30-31,34,38H,15,20-21H2,1-6H3,(H,35,39)(H,36,40)/t23-,30+,31-/m1/s1
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916n/an/an/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Binding affinity to recombinant memapsin 2


Bioorg Med Chem Lett 18: 1031-6 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.028
BindingDB Entry DOI: 10.7270/Q2513XZC
More data for this
Ligand-Target Pair
Beta-secretase 1


(Homo sapiens (Human))
BDBM50231935
PNG
((2,5-dimethyloxazol-4-yl)methyl (R)-1-((2S,3R)-4-(...)
Show SMILES COc1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)[C@H](CS(C)(=O)=O)NC(=O)OCc2nc(C)oc2C)c1
Show InChI InChI=1S/C29H38N4O8S/c1-19-25(31-20(2)41-19)17-40-29(36)33-26(18-42(4,37)38)28(35)32-24(14-21-9-6-5-7-10-21)27(34)16-30-15-22-11-8-12-23(13-22)39-3/h5-13,24,26-27,30,34H,14-18H2,1-4H3,(H,32,35)(H,33,36)/t24-,26-,27+/m0/s1
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1.50E+4n/an/an/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Binding affinity to recombinant memapsin 2


Bioorg Med Chem Lett 18: 1031-6 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.028
BindingDB Entry DOI: 10.7270/Q2513XZC
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM555248
PNG
(USRE49080, Example 16)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1ccc(Cl)c(Cc2ccc3CCCNc3c2)c1 |r|
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n/an/a 0.150n/an/an/an/an/an/a


TBA

Assay Description
The SGLT-2 assay is carried out as follows: CHO-hSGLT2 cells are cultivated in Ham's F12 Medium (BioWhittaker) with 10% foetal calf serum and 250...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20868J4
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM555251
PNG
(USRE49080, Example 21)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1ccc(Cl)c(Cc2ccc3OCCCc3c2)c1 |r|
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n/an/a 0.200n/an/an/an/an/an/a


TBA

Assay Description
The SGLT-2 assay is carried out as follows: CHO-hSGLT2 cells are cultivated in Ham's F12 Medium (BioWhittaker) with 10% foetal calf serum and 250...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20868J4
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM555247
PNG
(USRE49080, Example 15)
Show SMILES COc1ccc(CC2CCCc3cc(Cc4cc(ccc4Cl)[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)ccc23)cc1 |r|
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n/an/a 0.200n/an/an/an/an/an/a


TBA

Assay Description
The SGLT-2 assay is carried out as follows: CHO-hSGLT2 cells are cultivated in Ham's F12 Medium (BioWhittaker) with 10% foetal calf serum and 250...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20868J4
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM555242
PNG
(USRE49080, Example 8)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1ccc(Cl)c(Cc2ccc3OCCNc3c2)c1
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n/an/a 0.25n/an/an/an/an/an/a


TBA

Assay Description
The SGLT-2 assay is carried out as follows: CHO-hSGLT2 cells are cultivated in Ham's F12 Medium (BioWhittaker) with 10% foetal calf serum and 250...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20868J4
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM555255
PNG
(USRE49080, Example 28)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1ccc(Cl)c(Cc2ccc3NCCOc3c2)c1 |r|
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n/an/a 0.330n/an/an/an/an/an/a


TBA

Assay Description
The SGLT-2 assay is carried out as follows: CHO-hSGLT2 cells are cultivated in Ham's F12 Medium (BioWhittaker) with 10% foetal calf serum and 250...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20868J4
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM555263
PNG
(USRE49080, Example 42)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1ccc(Cl)c(Cc2ccc3NC(=O)COc3c2)c1 |r|
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n/an/a 0.350n/an/an/an/an/an/a


TBA

Assay Description
The SGLT-2 assay is carried out as follows: CHO-hSGLT2 cells are cultivated in Ham's F12 Medium (BioWhittaker) with 10% foetal calf serum and 250...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20868J4
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM555252
PNG
(USRE49080, Example 22)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1ccc(Cl)c(Cc2ccc3OCCc3c2)c1 |r|
PDB

UniProtKB/SwissProt

antibodypedia
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n/an/a 0.400n/an/an/an/an/an/a


TBA

Assay Description
The SGLT-2 assay is carried out as follows: CHO-hSGLT2 cells are cultivated in Ham's F12 Medium (BioWhittaker) with 10% foetal calf serum and 250...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20868J4
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM50560402
PNG
(LIK-066 | Licogliflozin | Lik066 | USRE49080, Exam...)
Show SMILES CCc1ccc(cc1Cc1ccc2OCCOc2c1)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
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n/an/a 0.5n/an/an/an/an/an/a


TBA

Assay Description
The SGLT-2 assay is carried out as follows: CHO-hSGLT2 cells are cultivated in Ham's F12 Medium (BioWhittaker) with 10% foetal calf serum and 250...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20868J4
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM555250
PNG
(USRE49080, Example 20)
Show SMILES CC1(C)CNc2cc(Cc3cc(ccc3Cl)[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)ccc2O1 |r|
PDB

UniProtKB/SwissProt

antibodypedia
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n/an/a 0.550n/an/an/an/an/an/a


TBA

Assay Description
The SGLT-2 assay is carried out as follows: CHO-hSGLT2 cells are cultivated in Ham's F12 Medium (BioWhittaker) with 10% foetal calf serum and 250...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20868J4
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM555249
PNG
(USRE49080, Example 17)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1ccc(Cl)c(Cc2ccc3NCCc3c2)c1 |r|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
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n/an/a 0.800n/an/an/an/an/an/a


TBA

Assay Description
The SGLT-2 assay is carried out as follows: CHO-hSGLT2 cells are cultivated in Ham's F12 Medium (BioWhittaker) with 10% foetal calf serum and 250...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20868J4
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM555270
PNG
(USRE49080, Example 66)
Show SMILES CCc1ccc(cc1Cc1ccc2OCCNc2c1)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |r|
PDB

UniProtKB/SwissProt

antibodypedia
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n/an/a 0.900n/an/an/an/an/an/a


TBA

Assay Description
The SGLT-2 assay is carried out as follows: CHO-hSGLT2 cells are cultivated in Ham's F12 Medium (BioWhittaker) with 10% foetal calf serum and 250...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20868J4
More data for this
Ligand-Target Pair
Beta-secretase 1


(Homo sapiens (Human))
BDBM50231937
PNG
(CHEMBL403268 | N-{(1S,2R)-1-benzyl-2-hydroxy-3-[(3...)
Show SMILES COc1cccc(CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)c2cc(cc(c2)C(=O)N[C@H](C)c2ccccc2)N(C)S(C)(=O)=O)c1
Show InChI InChI=1S/C36H42N4O6S/c1-25(28-15-9-6-10-16-28)38-35(42)29-20-30(22-31(21-29)40(2)47(4,44)45)36(43)39-33(19-26-12-7-5-8-13-26)34(41)24-37-23-27-14-11-17-32(18-27)46-3/h5-18,20-22,25,33-34,37,41H,19,23-24H2,1-4H3,(H,38,42)(H,39,43)/t25-,33+,34-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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n/an/a 1n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of memapsin 2 expressed in CHO cells


Bioorg Med Chem Lett 18: 1031-6 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.028
BindingDB Entry DOI: 10.7270/Q2513XZC
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM555271
PNG
(USRE49080, Example 69)
Show SMILES CC(C)c1ccc(cc1Cc1ccc2OCCNc2c1)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
PDB

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antibodypedia
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n/an/a 1.20n/an/an/an/an/an/a


TBA

Assay Description
The SGLT-2 assay is carried out as follows: CHO-hSGLT2 cells are cultivated in Ham's F12 Medium (BioWhittaker) with 10% foetal calf serum and 250...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20868J4
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM555257
PNG
(USRE49080, Example 31)
Show SMILES COc1ccc(cc1Cc1ccc2OCCNc2c1)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |r|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
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n/an/a 1.20n/an/an/an/an/an/a


TBA

Assay Description
The SGLT-2 assay is carried out as follows: CHO-hSGLT2 cells are cultivated in Ham's F12 Medium (BioWhittaker) with 10% foetal calf serum and 250...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20868J4
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM555253
PNG
(USRE49080, Example 24)
Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H](O)[C@@H]1O)c1ccc(F)c(Cc2ccc3OCCNc3c2)c1 |r|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
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PC cid
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n/an/a 1.30n/an/an/an/an/an/a


TBA

Assay Description
The SGLT-2 assay is carried out as follows: CHO-hSGLT2 cells are cultivated in Ham's F12 Medium (BioWhittaker) with 10% foetal calf serum and 250...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20868J4
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM555245
PNG
(USRE49080, Example 11)
Show SMILES CN1CCOc2ccc(Cc3cc(ccc3Cl)[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)cc12 |r|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
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PC cid
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n/an/a 1.40n/an/an/an/an/an/a


TBA

Assay Description
The SGLT-2 assay is carried out as follows: CHO-hSGLT2 cells are cultivated in Ham's F12 Medium (BioWhittaker) with 10% foetal calf serum and 250...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20868J4
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM555254
PNG
(USRE49080, Example 25)
Show SMILES COc1ccc(cc1Cc1ccc2OCCOc2c1)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |r|
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 1.5n/an/an/an/an/an/a


TBA

Assay Description
The SGLT-2 assay is carried out as follows: CHO-hSGLT2 cells are cultivated in Ham's F12 Medium (BioWhittaker) with 10% foetal calf serum and 250...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20868J4
More data for this
Ligand-Target Pair
Sodium/glucose cotransporter 2


(Homo sapiens (Human))
BDBM555272
PNG
(USRE49080, Example 71)
Show SMILES CC(C)c1ccc(cc1Cc1ccc2CCCNc2c1)[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 1.5n/an/an/an/an/an/a


TBA

Assay Description
The SGLT-2 assay is carried out as follows: CHO-hSGLT2 cells are cultivated in Ham's F12 Medium (BioWhittaker) with 10% foetal calf serum and 250...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20868J4
More data for this
Ligand-Target Pair
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