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Compile Data Set for Download or QSAR

Found 6 hits Enz. Inhib. hit(s) with Target = 'Tartrate-resistant acid phosphatase type 5'   
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
Tartrate-resistant acid phosphatase type 5


(Sus scrofa)
BDBM50469090
PNG
(CHEMBL4288392)
Show SMILES OC(=O)c1csc(n1)-c1cccc2ccccc12
Show InChI InChI=1S/C14H9NO2S/c16-14(17)12-8-18-13(15-12)11-7-3-5-9-4-1-2-6-10(9)11/h1-8H,(H,16,17)
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PubMed
3.30E+4n/an/an/an/an/an/an/an/a



The University of Queensland

Curated by ChEMBL


Assay Description
Competitive inhibition of pig purple acid phosphatase Fe(3)Fe(2) state assessed as enzyme-inhibitor complex using pNPP as substrate by UV/Vis spectro...


Eur J Med Chem 157: 462-479 (2018)


Article DOI: 10.1016/j.ejmech.2018.08.004
BindingDB Entry DOI: 10.7270/Q2J67KNV
More data for this
Ligand-Target Pair
Tartrate-resistant acid phosphatase type 5


(Sus scrofa)
BDBM50469089
PNG
(CHEMBL1405779)
Show SMILES Cc1ccc(cc1)-c1nc(cs1)C(O)=O
Show InChI InChI=1S/C11H9NO2S/c1-7-2-4-8(5-3-7)10-12-9(6-15-10)11(13)14/h2-6H,1H3,(H,13,14)
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PC sid
PDB
UniChem
Article
PubMed
4.20E+4n/an/an/an/an/an/an/an/a



The University of Queensland

Curated by ChEMBL


Assay Description
Competitive inhibition of pig purple acid phosphatase Fe(3)Fe(2) state assessed as enzyme-inhibitor complex using pNPP as substrate by UV/Vis spectro...


Eur J Med Chem 157: 462-479 (2018)


Article DOI: 10.1016/j.ejmech.2018.08.004
BindingDB Entry DOI: 10.7270/Q2J67KNV
More data for this
Ligand-Target Pair
Tartrate-resistant acid phosphatase type 5


(Sus scrofa)
BDBM55840
PNG
(2-(4-chlorophenyl)-1,3-thiazole-4-carboxylic acid ...)
Show SMILES OC(=O)c1csc(n1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C10H6ClNO2S/c11-7-3-1-6(2-4-7)9-12-8(5-15-9)10(13)14/h1-5H,(H,13,14)
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Article
PubMed
4.90E+4n/an/an/an/an/an/an/an/a



The University of Queensland

Curated by ChEMBL


Assay Description
Competitive inhibition of pig purple acid phosphatase Fe(3)Fe(2) state assessed as enzyme-inhibitor complex using pNPP as substrate by UV/Vis spectro...


Eur J Med Chem 157: 462-479 (2018)


Article DOI: 10.1016/j.ejmech.2018.08.004
BindingDB Entry DOI: 10.7270/Q2J67KNV
More data for this
Ligand-Target Pair
Tartrate-resistant acid phosphatase type 5


(Sus scrofa)
BDBM50469088
PNG
(CHEMBL4287988)
Show SMILES COc1ccc(cc1)-c1nc(cs1)C(O)=O
Show InChI InChI=1S/C11H9NO3S/c1-15-8-4-2-7(3-5-8)10-12-9(6-16-10)11(13)14/h2-6H,1H3,(H,13,14)
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PC cid
PC sid
UniChem
Article
PubMed
1.20E+5n/an/an/an/an/an/an/an/a



The University of Queensland

Curated by ChEMBL


Assay Description
Competitive inhibition of pig purple acid phosphatase Fe(3)Fe(2) state assessed as enzyme-inhibitor complex using pNPP as substrate by UV/Vis spectro...


Eur J Med Chem 157: 462-479 (2018)


Article DOI: 10.1016/j.ejmech.2018.08.004
BindingDB Entry DOI: 10.7270/Q2J67KNV
More data for this
Ligand-Target Pair
Tartrate-resistant acid phosphatase type 5


(Sus scrofa)
BDBM63710
PNG
(2-phenyl-1,3-thiazole-4-carboxylic acid | 2-phenyl...)
Show SMILES OC(=O)c1csc(n1)-c1ccccc1
Show InChI InChI=1S/C10H7NO2S/c12-10(13)8-6-14-9(11-8)7-4-2-1-3-5-7/h1-6H,(H,12,13)
PDB

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MCE
PC cid
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UniChem

Similars

Article
PubMed
1.90E+5n/an/an/an/an/an/an/an/a



The University of Queensland

Curated by ChEMBL


Assay Description
Competitive inhibition of pig purple acid phosphatase Fe(3)Fe(2) state assessed as enzyme-inhibitor complex using pNPP as substrate by UV/Vis spectro...


Eur J Med Chem 157: 462-479 (2018)


Article DOI: 10.1016/j.ejmech.2018.08.004
BindingDB Entry DOI: 10.7270/Q2J67KNV
More data for this
Ligand-Target Pair
Tartrate-resistant acid phosphatase type 5


(Sus scrofa)
BDBM50469091
PNG
(CHEMBL4283261)
Show SMILES OC(=O)c1csc(n1)-c1ccccc1Cl
Show InChI InChI=1S/C10H6ClNO2S/c11-7-4-2-1-3-6(7)9-12-8(5-15-9)10(13)14/h1-5H,(H,13,14)
PDB

UniProtKB/SwissProt

GoogleScholar
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MCE
PC cid
PC sid
UniChem
Article
PubMed
6.30E+5n/an/an/an/an/an/an/an/a



The University of Queensland

Curated by ChEMBL


Assay Description
Competitive inhibition of pig purple acid phosphatase Fe(3)Fe(2) state assessed as enzyme-inhibitor complex using pNPP as substrate by UV/Vis spectro...


Eur J Med Chem 157: 462-479 (2018)


Article DOI: 10.1016/j.ejmech.2018.08.004
BindingDB Entry DOI: 10.7270/Q2J67KNV
More data for this
Ligand-Target Pair