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Compile Data Set for Download or QSAR

Found 9 hits Enz. Inhib. hit(s) with Target = 'S-methyl-5-thioadenosine phosphorylase' AND taxid = 10090   
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
S-methyl-5-thioadenosine phosphorylase


(Mus musculus)
BDBM50368297
PNG
(CHEMBL62847)
Show SMILES CCCSC[C@H]1OC([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12
Show InChI InChI=1S/C13H19N5O3S/c1-2-3-22-4-7-9(19)10(20)13(21-7)18-6-17-8-11(14)15-5-16-12(8)18/h5-7,9-10,13,19-20H,2-4H2,1H3,(H2,14,15,16)/t7-,9-,10-,13?/m1/s1
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1.70E+3n/an/an/an/an/an/an/an/a



Institute

Curated by ChEMBL


Assay Description
The inhibitory constant(Ki) for MTA phosphorylase activity was determined by using a mouse liver enzyme preparation


J Med Chem 34: 2600-6 (1991)

More data for this
Ligand-Target Pair
S-methyl-5-thioadenosine phosphorylase


(Mus musculus)
BDBM50368299
PNG
(CHEMBL608305)
Show SMILES CCSC[C@H]1OC([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12
Show InChI InChI=1S/C12H17N5O3S/c1-2-21-3-6-8(18)9(19)12(20-6)17-5-16-7-10(13)14-4-15-11(7)17/h4-6,8-9,12,18-19H,2-3H2,1H3,(H2,13,14,15)/t6-,8-,9-,12?/m1/s1
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1.90E+3n/an/an/an/an/an/an/an/a



Institute

Curated by ChEMBL


Assay Description
The inhibitory constant(Ki) for MTA phosphorylase activity was determined by using a mouse liver enzyme preparation


J Med Chem 34: 2600-6 (1991)

More data for this
Ligand-Target Pair
S-methyl-5-thioadenosine phosphorylase


(Mus musculus)
BDBM50368302
PNG
(CHEMBL609198)
Show SMILES Nc1ncnc2n(cnc12)C1O[C@H](CSCCF)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C12H16FN5O3S/c13-1-2-22-3-6-8(19)9(20)12(21-6)18-5-17-7-10(14)15-4-16-11(7)18/h4-6,8-9,12,19-20H,1-3H2,(H2,14,15,16)/t6-,8-,9-,12?/m1/s1
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3.10E+3n/an/an/an/an/an/an/an/a



Institute

Curated by ChEMBL


Assay Description
The inhibitory constant(Ki) for MTA phosphorylase activity was determined by using a mouse liver enzyme preparation


J Med Chem 34: 2600-6 (1991)

More data for this
Ligand-Target Pair
S-methyl-5-thioadenosine phosphorylase


(Mus musculus)
BDBM50367877
PNG
(CHEMBL606332)
Show SMILES Nc1ncnc2n(cnc12)C1O[C@H](CSCF)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C11H14FN5O3S/c12-2-21-1-5-7(18)8(19)11(20-5)17-4-16-6-9(13)14-3-15-10(6)17/h3-5,7-8,11,18-19H,1-2H2,(H2,13,14,15)/t5-,7-,8-,11?/m1/s1
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3.30E+3n/an/an/an/an/an/an/an/a



Institute

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of mouse liver MTA phosphorylase


J Med Chem 32: 997-1001 (1989)

More data for this
Ligand-Target Pair
S-methyl-5-thioadenosine phosphorylase


(Mus musculus)
BDBM50368298
PNG
(CHEMBL611249)
Show SMILES Nc1ncnc2n(cnc12)C1O[C@H](CSCCCF)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C13H18FN5O3S/c14-2-1-3-23-4-7-9(20)10(21)13(22-7)19-6-18-8-11(15)16-5-17-12(8)19/h5-7,9-10,13,20-21H,1-4H2,(H2,15,16,17)/t7-,9-,10-,13?/m1/s1
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4.00E+3n/an/an/an/an/an/an/an/a



Institute

Curated by ChEMBL


Assay Description
The inhibitory constant(Ki) for MTA phosphorylase activity was determined by using a mouse liver enzyme preparation


J Med Chem 34: 2600-6 (1991)

More data for this
Ligand-Target Pair
S-methyl-5-thioadenosine phosphorylase


(Mus musculus)
BDBM50368301
PNG
(CHEMBL606448)
Show SMILES Nc1ncnc2n(cnc12)C1O[C@H](CSCCBr)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C12H16BrN5O3S/c13-1-2-22-3-6-8(19)9(20)12(21-6)18-5-17-7-10(14)15-4-16-11(7)18/h4-6,8-9,12,19-20H,1-3H2,(H2,14,15,16)/t6-,8-,9-,12?/m1/s1
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6.50E+3n/an/an/an/an/an/an/an/a



Institute

Curated by ChEMBL


Assay Description
The inhibitory constant(Ki) for MTA phosphorylase activity was determined by using a mouse liver enzyme preparation


J Med Chem 34: 2600-6 (1991)

More data for this
Ligand-Target Pair
S-methyl-5-thioadenosine phosphorylase


(Mus musculus)
BDBM50368296
PNG
(CHEMBL608607)
Show SMILES Nc1ncnc2n(cnc12)C1O[C@H](CSCCCl)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C12H16ClN5O3S/c13-1-2-22-3-6-8(19)9(20)12(21-6)18-5-17-7-10(14)15-4-16-11(7)18/h4-6,8-9,12,19-20H,1-3H2,(H2,14,15,16)/t6-,8-,9-,12?/m1/s1
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1.20E+4n/an/an/an/an/an/an/an/a



Institute

Curated by ChEMBL


Assay Description
The inhibitory constant(Ki) for MTA phosphorylase activity was determined by using a mouse liver enzyme preparation


J Med Chem 34: 2600-6 (1991)

More data for this
Ligand-Target Pair
S-methyl-5-thioadenosine phosphorylase


(Mus musculus)
BDBM50368300
PNG
(CHEMBL608307)
Show SMILES Nc1ncnc2n(cnc12)C1O[C@H](CSCCO)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C12H17N5O4S/c13-10-7-11(15-4-14-10)17(5-16-7)12-9(20)8(19)6(21-12)3-22-2-1-18/h4-6,8-9,12,18-20H,1-3H2,(H2,13,14,15)/t6-,8-,9-,12?/m1/s1
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2.60E+4n/an/an/an/an/an/an/an/a



Institute

Curated by ChEMBL


Assay Description
The inhibitory constant(Ki) for MTA phosphorylase activity was determined by using a mouse liver enzyme preparation


J Med Chem 34: 2600-6 (1991)

More data for this
Ligand-Target Pair
S-methyl-5-thioadenosine phosphorylase


(Mus musculus)
BDBM50367876
PNG
(CHEMBL606328)
Show SMILES CSC(F)C[C@H]1OC([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12
Show InChI InChI=1S/C12H16FN5O3S/c1-22-6(13)2-5-8(19)9(20)12(21-5)18-4-17-7-10(14)15-3-16-11(7)18/h3-6,8-9,12,19-20H,2H2,1H3,(H2,14,15,16)/t5-,6?,8-,9-,12?/m1/s1
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1.41E+5n/an/an/an/an/an/an/an/a



Institute

Curated by ChEMBL


Assay Description
Compound was evaluated for the inhibition of rat liver MTA phosphorylase


J Med Chem 32: 997-1001 (1989)

More data for this
Ligand-Target Pair