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Compile Data Set for Download or QSAR

Found 9 hits Enz. Inhib. hit(s) with Target = '5'-nucleotidase'   
Target
(Institution)
LigandTarget
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
5'-nucleotidase


(Homo sapiens)
BDBM50443532
PNG
(CHEMBL3087995)
Show SMILES Nc1ccc2cc(cc(O)c2c1)S(O)(=O)=O
Show InChI InChI=1S/C10H9NO4S/c11-7-2-1-6-3-8(16(13,14)15)5-10(12)9(6)4-7/h1-5,12H,11H2,(H,13,14,15)
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n/an/a 1.32E+3n/an/an/an/an/an/a



COMSATS Institute of Information Technology

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ecto-5'-nucleotidase expressed in african green monkey COS7 cells using adenosine monophosphate as substrate preincub...


Citation and Details
More data for this
Ligand-Target Pair
5'-nucleotidase


(Homo sapiens)
BDBM50443528
PNG
(CHEMBL3088000)
Show SMILES Cc1cc(=O)n([nH]1)-c1ccc(cc1)S(O)(=O)=O
Show InChI InChI=1S/C10H10N2O4S/c1-7-6-10(13)12(11-7)8-2-4-9(5-3-8)17(14,15)16/h2-6,11H,1H3,(H,14,15,16)
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n/an/a 6.10E+3n/an/an/an/an/an/a



COMSATS Institute of Information Technology

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ecto-5'-nucleotidase expressed in african green monkey COS7 cells using adenosine monophosphate as substrate preincub...


Citation and Details
More data for this
Ligand-Target Pair
5'-nucleotidase


(Homo sapiens)
BDBM50443531
PNG
(CHEBI:27500 | CHEMBL1566888)
Show SMILES Nc1ccc(cc1)S(O)(=O)=O
Show InChI InChI=1S/C6H7NO3S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,7H2,(H,8,9,10)
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n/an/a 8.20E+3n/an/an/an/an/an/a



COMSATS Institute of Information Technology

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ecto-5'-nucleotidase expressed in african green monkey COS7 cells using adenosine monophosphate as substrate preincub...


Citation and Details
More data for this
Ligand-Target Pair
5'-nucleotidase


(Homo sapiens)
BDBM50443527
PNG
(CHEMBL1339340)
Show SMILES Cc1ccc2nc(sc2c1S(O)(=O)=O)-c1ccc(N)cc1
Show InChI InChI=1S/C14H12N2O3S2/c1-8-2-7-11-12(13(8)21(17,18)19)20-14(16-11)9-3-5-10(15)6-4-9/h2-7H,15H2,1H3,(H,17,18,19)
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n/an/a 1.35E+4n/an/an/an/an/an/a



COMSATS Institute of Information Technology

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ecto-5'-nucleotidase expressed in african green monkey COS7 cells using adenosine monophosphate as substrate preincub...


Citation and Details
More data for this
Ligand-Target Pair
5'-nucleotidase


(Homo sapiens)
BDBM50000035
PNG
(4-Amino-5-hydroxy-naphthalene-2,7-disulfonic acid;...)
Show SMILES Nc1cc(cc2cc(cc(O)c12)S(O)(=O)=O)S(O)(=O)=O
Show InChI InChI=1S/C10H9NO7S2/c11-8-3-6(19(13,14)15)1-5-2-7(20(16,17)18)4-9(12)10(5)8/h1-4,12H,11H2,(H,13,14,15)(H,16,17,18)
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n/an/a 2.18E+4n/an/an/an/an/an/a



COMSATS Institute of Information Technology

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ecto-5'-nucleotidase expressed in african green monkey COS7 cells using adenosine monophosphate as substrate preincub...


Citation and Details
More data for this
Ligand-Target Pair
5'-nucleotidase


(Homo sapiens)
BDBM50443533
PNG
(CHEMBL3087996)
Show SMILES NC(=O)Nc1ccc2cc(cc(O)c2c1)S(O)(=O)=O
Show InChI InChI=1S/C11H10N2O5S/c12-11(15)13-7-2-1-6-3-8(19(16,17)18)5-10(14)9(6)4-7/h1-5,14H,(H3,12,13,15)(H,16,17,18)
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n/an/a 3.05E+4n/an/an/an/an/an/a



COMSATS Institute of Information Technology

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ecto-5'-nucleotidase expressed in african green monkey COS7 cells using adenosine monophosphate as substrate preincub...


Citation and Details
More data for this
Ligand-Target Pair
5'-nucleotidase


(Homo sapiens)
BDBM50443529
PNG
(CHEMBL3087999)
Show SMILES Nc1c(O)cc(c2cc(ccc12)[N+]([O-])=O)S(O)(=O)=O
Show InChI InChI=1S/C10H8N2O6S/c11-10-6-2-1-5(12(14)15)3-7(6)9(4-8(10)13)19(16,17)18/h1-4,13H,11H2,(H,16,17,18)
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n/an/a 4.10E+4n/an/an/an/an/an/a



COMSATS Institute of Information Technology

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ecto-5'-nucleotidase expressed in african green monkey COS7 cells using adenosine monophosphate as substrate preincub...


Citation and Details
More data for this
Ligand-Target Pair
5'-nucleotidase


(Homo sapiens)
BDBM26994
PNG
(CHEMBL68253 | H2NSO3H | sulfamic acid)
Show SMILES NS(O)(=O)=O
Show InChI InChI=1S/H3NO3S/c1-5(2,3)4/h(H3,1,2,3,4)
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PubMed
n/an/a 4.21E+4n/an/an/an/an/an/a



COMSATS Institute of Information Technology

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ecto-5'-nucleotidase expressed in african green monkey COS7 cells using adenosine monophosphate as substrate preincub...


Citation and Details
More data for this
Ligand-Target Pair
5'-nucleotidase


(Homo sapiens)
BDBM50443530
PNG
(CHEMBL3087998)
Show SMILES Nc1ccc(Nc2ccc(cc2)[N+]([O-])=O)c(c1)S(O)(=O)=O
Show InChI InChI=1S/C12H11N3O5S/c13-8-1-6-11(12(7-8)21(18,19)20)14-9-2-4-10(5-3-9)15(16)17/h1-7,14H,13H2,(H,18,19,20)
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n/an/a 4.76E+4n/an/an/an/an/an/a



COMSATS Institute of Information Technology

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ecto-5'-nucleotidase expressed in african green monkey COS7 cells using adenosine monophosphate as substrate preincub...


Citation and Details
More data for this
Ligand-Target Pair