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Compile Data Set for Download or QSAR

Found 5 hits of ic50 for UniProtKB: P04040   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Catalase


(Homo sapiens (Human))
BDBM50541448
PNG
(CHEMBL4633785)
Show SMILES [H][C@@]12C[C@]1([H])c1ccc(F)c(C(O)=O)c1OB2O |r|
Show InChI InChI=1S/C10H8BFO4/c12-7-2-1-4-5-3-6(5)11(15)16-9(4)8(7)10(13)14/h1-2,5-6,15H,3H2,(H,13,14)/t5-,6-/m1/s1
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MCE
PC cid
PC sid
PDB
UniChem
Article
PubMed
n/an/a 1.10E+3n/an/an/an/an/an/a



Qpex Biopharma, Inc.

Curated by ChEMBL


Assay Description
Inhibition of mammalian cathepsin A (unknown origin) using MCA-RPPGFSAFK-Dnp as substrate preincubated for 10 mins followed by substrate addition mea...


J Med Chem 63: 7491-7507 (2020)


Article DOI: 10.1021/acs.jmedchem.9b01976
BindingDB Entry DOI: 10.7270/Q2377D7Q
More data for this
Ligand-Target Pair
Catalase


(Homo sapiens (Human))
BDBM50127136
PNG
(CHEMBL1442185)
Show SMILES Cc1ccccc1Cn1nnc2c1C(=O)c1ccccc1C2=O
Show InChI InChI=1S/C18H13N3O2/c1-11-6-2-3-7-12(11)10-21-16-15(19-20-21)17(22)13-8-4-5-9-14(13)18(16)23/h2-9H,10H2,1H3
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Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibition of catalase (unknown origin)


J Med Chem 58: 7807-19 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00921
BindingDB Entry DOI: 10.7270/Q2JS9S7K
More data for this
Ligand-Target Pair
Catalase


(Homo sapiens (Human))
BDBM50127174
PNG
(CHEMBL3628599)
Show SMILES CN1CCN(CC1)C(=O)c1cccc(Cn2nnc3c2C(=O)c2ccccc2C3=O)c1
Show InChI InChI=1S/C23H21N5O3/c1-26-9-11-27(12-10-26)23(31)16-6-4-5-15(13-16)14-28-20-19(24-25-28)21(29)17-7-2-3-8-18(17)22(20)30/h2-8,13H,9-12,14H2,1H3
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PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibition of catalase (unknown origin)


J Med Chem 58: 7807-19 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00921
BindingDB Entry DOI: 10.7270/Q2JS9S7K
More data for this
Ligand-Target Pair
Catalase


(Homo sapiens (Human))
BDBM50146461
PNG
(CHEMBL3765807)
Show SMILES Cl.NOCc1cccc(Cl)c1
Show InChI InChI=1S/C7H8ClNO.ClH/c8-7-3-1-2-6(4-7)5-10-9;/h1-4H,5,9H2;1H
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Bryn Mawr College

Curated by ChEMBL


Assay Description
Inhibition of catalase (unknown origin) using hydrogen peroxide as substrate


Eur J Med Chem 108: 564-76 (2016)


Article DOI: 10.1016/j.ejmech.2015.12.028
BindingDB Entry DOI: 10.7270/Q26Q203T
More data for this
Ligand-Target Pair
Catalase


(Homo sapiens (Human))
BDBM50146460
PNG
(CHEMBL3763688)
Show SMILES Cl.NOCc1ccc(I)cc1
Show InChI InChI=1S/C7H8INO.ClH/c8-7-3-1-6(2-4-7)5-10-9;/h1-4H,5,9H2;1H
PDB

UniProtKB/SwissProt

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PC sid
UniChem

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Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Bryn Mawr College

Curated by ChEMBL


Assay Description
Inhibition of catalase (unknown origin) using hydrogen peroxide as substrate


Eur J Med Chem 108: 564-76 (2016)


Article DOI: 10.1016/j.ejmech.2015.12.028
BindingDB Entry DOI: 10.7270/Q26Q203T
More data for this
Ligand-Target Pair