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PubMed code 10662686

Compile data set for download or QSAR
Found 6 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cathepsin B


(Homo sapiens (Human))
BDBM36812
PNG
(CA-074)
Show SMILES CCCNC1OC1C(=O)N[C@@H](C(C)CC)C(=O)N1CCC[C@@H]1C(O)=O |r|
Show InChI InChI=1S/C17H29N3O5/c1-4-8-18-15-13(25-15)14(21)19-12(10(3)5-2)16(22)20-9-6-7-11(20)17(23)24/h10-13,15,18H,4-9H2,1-3H3,(H,19,21)(H,23,24)/t10?,11-,12+,13?,15?/m1/s1
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Article
PubMed
n/an/a 40n/an/an/an/a5.525



University of California, San Francisco



Assay Description
Inhibition assay using pre-treatment of recombinant cathepsin-L-like cysteine protease cruzain lacking the carboxy-terminal domain or cathepsin B fr...


Chem Biol 7: 27-38 (2000)


Article DOI: 10.1016/s1074-5521(00)00061-2
BindingDB Entry DOI: 10.7270/Q24B2ZN5
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))
BDBM36813
PNG
(CA-074b)
Show SMILES CCC(C)[C@H](NC(=O)C1OC1NCC(C)C)C(=O)N1CCC[C@@H]1C(O)=O |r|
Show InChI InChI=1S/C18H31N3O5/c1-5-11(4)13(17(23)21-8-6-7-12(21)18(24)25)20-15(22)14-16(26-14)19-9-10(2)3/h10-14,16,19H,5-9H2,1-4H3,(H,20,22)(H,24,25)/t11?,12-,13+,14?,16?/m1/s1
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Article
PubMed
n/an/a 60n/an/an/an/a5.525



University of California, San Francisco



Assay Description
Inhibition assay using pre-treatment of recombinant cathepsin-L-like cysteine protease cruzain lacking the carboxy-terminal domain or cathepsin B fr...


Chem Biol 7: 27-38 (2000)


Article DOI: 10.1016/s1074-5521(00)00061-2
BindingDB Entry DOI: 10.7270/Q24B2ZN5
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))
BDBM36814
PNG
(MB-074)
Show SMILES CCC(C)[C@H](NC(=O)C1OC1NCCc1ccc(O)cc1)C(=O)N1OCC[C@@H]1C(O)=O |r|
Show InChI InChI=1S/C21H29N3O7/c1-3-12(2)16(20(27)24-15(21(28)29)9-11-30-24)23-18(26)17-19(31-17)22-10-8-13-4-6-14(25)7-5-13/h4-7,12,15-17,19,22,25H,3,8-11H2,1-2H3,(H,23,26)(H,28,29)/t12?,15-,16+,17?,19?/m1/s1
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UniChem
Article
PubMed
n/an/a 400n/an/an/an/a5.525



University of California, San Francisco



Assay Description
Inhibition assay using pre-treatment of recombinant cathepsin-L-like cysteine protease cruzain lacking the carboxy-terminal domain or cathepsin B fr...


Chem Biol 7: 27-38 (2000)


Article DOI: 10.1016/s1074-5521(00)00061-2
BindingDB Entry DOI: 10.7270/Q24B2ZN5
More data for this
Ligand-Target Pair
Procathepsin L [114-333,T223A]


(Homo sapiens (Human))
BDBM36814
PNG
(MB-074)
Show SMILES CCC(C)[C@H](NC(=O)C1OC1NCCc1ccc(O)cc1)C(=O)N1OCC[C@@H]1C(O)=O |r|
Show InChI InChI=1S/C21H29N3O7/c1-3-12(2)16(20(27)24-15(21(28)29)9-11-30-24)23-18(26)17-19(31-17)22-10-8-13-4-6-14(25)7-5-13/h4-7,12,15-17,19,22,25H,3,8-11H2,1-2H3,(H,23,26)(H,28,29)/t12?,15-,16+,17?,19?/m1/s1
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UniChem
Article
PubMed
n/an/a>1.00E+4n/an/an/an/a5.525



University of California, San Francisco



Assay Description
Inhibition assay using pre-treatment of recombinant cathepsin-L-like cysteine protease cruzain lacking the carboxy-terminal domain or cathepsin B fr...


Chem Biol 7: 27-38 (2000)


Article DOI: 10.1016/s1074-5521(00)00061-2
BindingDB Entry DOI: 10.7270/Q24B2ZN5
More data for this
Ligand-Target Pair
Procathepsin L [114-333,T223A]


(Homo sapiens (Human))
BDBM36813
PNG
(CA-074b)
Show SMILES CCC(C)[C@H](NC(=O)C1OC1NCC(C)C)C(=O)N1CCC[C@@H]1C(O)=O |r|
Show InChI InChI=1S/C18H31N3O5/c1-5-11(4)13(17(23)21-8-6-7-12(21)18(24)25)20-15(22)14-16(26-14)19-9-10(2)3/h10-14,16,19H,5-9H2,1-4H3,(H,20,22)(H,24,25)/t11?,12-,13+,14?,16?/m1/s1
PDB
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UniProtKB/SwissProt

B.MOAD
GoogleScholar
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KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/a5.525



University of California, San Francisco



Assay Description
Inhibition assay using pre-treatment of recombinant cathepsin-L-like cysteine protease cruzain lacking the carboxy-terminal domain or cathepsin B fr...


Chem Biol 7: 27-38 (2000)


Article DOI: 10.1016/s1074-5521(00)00061-2
BindingDB Entry DOI: 10.7270/Q24B2ZN5
More data for this
Ligand-Target Pair
Procathepsin L [114-333,T223A]


(Homo sapiens (Human))
BDBM36812
PNG
(CA-074)
Show SMILES CCCNC1OC1C(=O)N[C@@H](C(C)CC)C(=O)N1CCC[C@@H]1C(O)=O |r|
Show InChI InChI=1S/C17H29N3O5/c1-4-8-18-15-13(25-15)14(21)19-12(10(3)5-2)16(22)20-9-6-7-11(20)17(23)24/h10-13,15,18H,4-9H2,1-3H3,(H,19,21)(H,23,24)/t10?,11-,12+,13?,15?/m1/s1
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/a5.525



University of California, San Francisco



Assay Description
Inhibition assay using pre-treatment of recombinant cathepsin-L-like cysteine protease cruzain lacking the carboxy-terminal domain or cathepsin B fr...


Chem Biol 7: 27-38 (2000)


Article DOI: 10.1016/s1074-5521(00)00061-2
BindingDB Entry DOI: 10.7270/Q24B2ZN5
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%