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Compile Data Set for Download or QSAR

Found 67 hits with Last Name = 'patel' and Initial = 'kv'   
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 D


(Homo sapiens (Human))
BDBM50080960
PNG
(2-Bromo-N-[(1S,2S)-3-{[2-(2,4-dichloro-phenyl)-eth...)
Show SMILES COc1cc(Br)c(cc1OC)C(=O)N[C@@H](Cc1cccc(Oc2ccccc2)c1)[C@@H](O)CN(CCc1ccc(Cl)cc1Cl)C(=O)CCN1C(=O)c2ccccc2C1=O
Show InChI InChI=1S/C44H40BrCl2N3O8/c1-56-39-24-34(35(45)25-40(39)57-2)42(53)48-37(22-27-9-8-12-31(21-27)58-30-10-4-3-5-11-30)38(51)26-49(19-17-28-15-16-29(46)23-36(28)47)41(52)18-20-50-43(54)32-13-6-7-14-33(32)44(50)55/h3-16,21,23-25,37-38,51H,17-20,22,26H2,1-2H3,(H,48,53)/t37-,38-/m0/s1
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0.700n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human liver Cathepsin D using (Ac-Glu-Glu(Edans)-Lys-Pro-Ile-Cys-Phe-PheArg-Leu-Gly-Lys(Dabcyl)-Glu-NH2) peptide as substrate by fluoro...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Cathepsin D


(Homo sapiens (Human))
BDBM912
PNG
((3S,4S)-3-hydroxy-4-[(2S)-2-[(3S,4S)-3-hydroxy-6-m...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CC(C)C)C(C)C)C(C)C)[C@@H](O)CC(O)=O |r|
Show InChI InChI=1S/C34H63N5O9/c1-17(2)12-23(37-33(47)31(21(9)10)39-34(48)30(20(7)8)38-27(42)14-19(5)6)25(40)15-28(43)35-22(11)32(46)36-24(13-18(3)4)26(41)16-29(44)45/h17-26,30-31,40-41H,12-16H2,1-11H3,(H,35,43)(H,36,46)(H,37,47)(H,38,42)(H,39,48)(H,44,45)/t22-,23-,24-,25-,26-,30-,31-/m0/s1
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n/an/a<1n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Cathepsin D (unknown origin)


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555173
PNG
(CHEMBL4754691)
Show SMILES OC(=O)C(F)(F)F.CNS(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)c1 |r|
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n/an/a 4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555188
PNG
(CHEMBL4751867)
Show SMILES OC(=O)C(F)(F)F.CNS(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(OC)c(Cl)c2)c1 |r|
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n/an/a 5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555179
PNG
(CHEMBL4783048)
Show SMILES OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)Nc2cc(ccc2C)S(N)(=O)=O)cc1OC |r|
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n/an/a 7n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555170
PNG
(CHEMBL4779266)
Show SMILES OC(=O)C(F)(F)F.CCN(CC)S(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)c1 |r|
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n/an/a 8n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555209
PNG
(CHEMBL4794632)
Show SMILES OC(=O)C(F)(F)F.CCCC[C@@H](NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1)C(=O)Nc1cc(ccc1C)S(N)(=O)=O |r|
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n/an/a 8n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555201
PNG
(CHEMBL4791638)
Show SMILES OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](C2CCCCC2)C(=O)Nc2cc(ccc2C)S(N)(=O)=O)cc1OC |r|
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n/an/a 9n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555189
PNG
(CHEMBL4792649)
Show SMILES OC(=O)C(F)(F)F.CNS(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2cc(Cl)cc(OC)c2)c1 |r|
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n/an/a 10n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555171
PNG
(CHEMBL4741771)
Show SMILES OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)Nc2cc(ccc2C)S(=O)(=O)N(C(C)C)C(C)C)cc1OC |r|
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n/an/a 11n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555176
PNG
(CHEMBL4798170)
Show SMILES OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)Nc2cc(ccc2C)S(=O)(=O)N2CCOCC2)cc1OC |r|
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n/an/a 12n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555178
PNG
(CHEMBL4794580)
Show SMILES OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)Nc2cc(ccc2C)N(S(C)(=O)=O)S(C)(=O)=O)cc1OC |r|
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n/an/a 15n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555193
PNG
(CHEMBL4746757)
Show SMILES OC(=O)C(F)(F)F.CNS(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(OC)c(c2)C(F)(F)F)c1 |r|
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n/an/a 16n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555190
PNG
(CHEMBL4755364)
Show SMILES OC(=O)C(F)(F)F.CNS(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2cc(Cl)cc(c2)C(F)(F)F)c1 |r|
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n/an/a 18n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555194
PNG
(CHEMBL4751432)
Show SMILES OC(=O)C(F)(F)F.CNS(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(cc2)S(C)(=O)=O)c1 |r|
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n/an/a 25n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555157
PNG
(CHEMBL4799250)
Show SMILES OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)Nc2cc(ccc2C)S(=O)(=O)N(C)C)cc1OC |r|
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n/an/a 29n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555174
PNG
(CHEMBL4749657)
Show SMILES OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)Nc2cc(ccc2C)S(=O)(=O)NC2CC2)cc1OC |r|
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n/an/a 30n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555191
PNG
(CHEMBL4747915)
Show SMILES OC(=O)C(F)(F)F.CNS(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(Cl)c(Cl)c2)c1 |r|
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n/an/a 36n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555160
PNG
(CHEMBL4747598)
Show SMILES OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)Nc2cc(ccc2C)S(=O)(=O)N(C)C)cc1F |r|
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n/an/a 44n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555210
PNG
(CHEMBL4755936)
Show SMILES OC(=O)C(F)(F)F.CCC[C@@H](NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1)C(=O)Nc1cc(ccc1C)S(N)(=O)=O |r|
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n/an/a 45n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555218
PNG
(CHEMBL4745201)
Show SMILES OC(=O)C(F)(F)F.CCOC[C@@H](NC(=N)NC(=O)Cc1ccc(OC)c(OC)c1)C(=O)Nc1cc(ccc1C)S(N)(=O)=O |r|
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n/an/a 45n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555161
PNG
(CHEMBL4743108)
Show SMILES OC(=O)C(F)(F)F.CN(C)S(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2cccc(c2)C#N)c1 |r|
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n/an/a 51n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555167
PNG
(CHEMBL4747539)
Show SMILES OC(=O)C(F)(F)F.COc1ccc(CCC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)Nc2cc(ccc2C)S(=O)(=O)N(C)C)cc1OC |r|
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n/an/a 53n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555162
PNG
(CHEMBL4787350)
Show SMILES OC(=O)C(F)(F)F.CN(C)S(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccccc2C(F)(F)F)c1 |r|
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n/an/a 53n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555164
PNG
(CHEMBL4743293)
Show SMILES OC(=O)C(F)(F)F.CN(C)S(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(cc2)C(F)(F)F)c1 |r|
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TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555181
PNG
(CHEMBL4788968)
Show SMILES OC(=O)C(F)(F)F.CNS(=O)(=O)c1ccc(C)c(NC(=O)[C@H](NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)C2CCCCC2)c1 |r|
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TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555172
PNG
(CHEMBL4788309)
Show SMILES OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)Nc2cc(ccc2C)S(=O)(=O)NC(C)C)cc1OC |r|
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TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555195
PNG
(CHEMBL4763902)
Show SMILES OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2)C(=O)Nc2cc(ccc2C)S(N)(=O)=O)cc1OC |r|
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TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555159
PNG
(CHEMBL4759490)
Show SMILES OC(=O)C(F)(F)F.CN(C)S(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(F)c(F)c2)c1 |r|
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TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555163
PNG
(CHEMBL4755601)
Show SMILES OC(=O)C(F)(F)F.CN(C)S(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2cccc(c2)C(F)(F)F)c1 |r|
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TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555158
PNG
(CHEMBL4778127)
Show SMILES OC(=O)C(F)(F)F.CN(C)S(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc(Cl)c(Cl)c2)c1 |r|
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TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555202
PNG
(CHEMBL4786011)
Show SMILES OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@@H](C(=O)Nc2cc(ccc2C)S(N)(=O)=O)C2=CCC=CC2)cc1OC |r,c:38,t:35|
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TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555206
PNG
(CHEMBL4777316)
Show SMILES OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](CC(C)C)C(=O)Nc2cc(ccc2C)S(N)(=O)=O)cc1OC |r|
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TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555177
PNG
(CHEMBL4756722)
Show SMILES OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)Nc2cc(ccc2C)S(=O)(=O)N2CCN(C)CC2)cc1OC |r|
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TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555169
PNG
(CHEMBL4757469)
Show SMILES OC(=O)C(F)(F)F.CN(C)S(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)C2CCCc3ccccc23)c1 |r|
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TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555204
PNG
(CHEMBL4740277)
Show SMILES OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](CC2CC2)C(=O)Nc2cc(ccc2C)S(N)(=O)=O)cc1OC |r|
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TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555168
PNG
(CHEMBL4795048)
Show SMILES OC(=O)C(F)(F)F.CN(C)S(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2ccc3ccccc3c2)c1 |r|
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TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555205
PNG
(CHEMBL4743795)
Show SMILES OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](C2CC2)C(=O)Nc2cc(ccc2C)S(N)(=O)=O)cc1OC |r|
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TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555182
PNG
(CHEMBL4753545)
Show SMILES OC(=O)C(F)(F)F.CNS(=O)(=O)c1ccc(C)c(NC(=O)[C@H](NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)c2ccccc2)c1 |r|
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TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555192
PNG
(CHEMBL4797663)
Show SMILES OC(=O)C(F)(F)F.CNS(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c1 |r|
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TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555197
PNG
(CHEMBL4743799)
Show SMILES OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](Cc2cccs2)C(=O)Nc2cc(ccc2C)S(N)(=O)=O)cc1OC |r|
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TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555198
PNG
(CHEMBL4760681)
Show SMILES OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](Cc2cc3ccccc3s2)C(=O)Nc2cc(ccc2C)S(N)(=O)=O)cc1OC |r|
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TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555183
PNG
(CHEMBL4778460)
Show SMILES OC(=O)C(F)(F)F.CNS(=O)(=O)c1ccc(C)c(NC(=O)[C@H](NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)C(C)C)c1 |r|
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TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555216
PNG
(CHEMBL4755672)
Show SMILES OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](CCSC)C(=O)Nc2cc(ccc2C)S(N)(=O)=O)cc1OC |r|
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TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555175
PNG
(CHEMBL4740385)
Show SMILES OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](CC2CCCCC2)C(=O)Nc2cc(ccc2C)S(=O)(=O)NC2CCCCC2)cc1OC |r|
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TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555165
PNG
(CHEMBL4792598)
Show SMILES OC(=O)C(F)(F)F.CN(C)S(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](CC2CCCCC2)NC(=N)NC(=O)Cc2cc(cc(c2)C(F)(F)F)C(F)(F)F)c1 |r|
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TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555185
PNG
(CHEMBL4791822)
Show SMILES OC(=O)C(F)(F)F.CNS(=O)(=O)c1ccc(C)c(NC(=O)[C@@H](Cc2ccccc2)NC(=N)NC(=O)Cc2ccc(OC)c(OC)c2)c1 |r|
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Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50080991
PNG
(5-[1-[4-(4-Benzoyl-3-hydroxy-2-propyl-phenoxymethy...)
Show SMILES CCCc1c(O)c(ccc1OCc1ccc(C=C2SC(S)=NC2=O)cc1)C(=O)c1ccccc1 |w:16.16,c:21|
Show InChI InChI=1S/C27H23NO4S2/c1-2-6-20-22(14-13-21(25(20)30)24(29)19-7-4-3-5-8-19)32-16-18-11-9-17(10-12-18)15-23-26(31)28-27(33)34-23/h3-5,7-15,30H,2,6,16H2,1H3,(H,28,31,33)
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Article
PubMed
n/an/a 210n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Cathepsin D (unknown origin)


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555208
PNG
(CHEMBL4741742)
Show SMILES OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@@H](C(=O)Nc2cc(ccc2C)S(N)(=O)=O)C(C)(C)C)cc1OC |r|
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 212n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
Cathepsin D


(Homo sapiens (Human))
BDBM50555196
PNG
(CHEMBL4796144)
Show SMILES OC(=O)C(F)(F)F.COc1ccc(CC(=O)NC(=N)N[C@H](Cc2ccccc2F)C(=O)Nc2cc(ccc2C)S(N)(=O)=O)cc1OC |r|
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 225n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human liver Cathepsin D preincubated for 10 mins followed by substrate addition and further incubated for 2 hrs in dark by fluorimetric...


Citation and Details

Article DOI: 10.1016/j.bmc.2020.115879
BindingDB Entry DOI: 10.7270/Q2HQ43KW
More data for this
Ligand-Target Pair
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