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Compile Data Set for Download or QSAR

Found 13 hits of ki for UniProtKB: P85973   
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
Purine nucleoside phosphorylase


(Rattus norvegicus)
BDBM50039551
PNG
(CHEMBL13448 | [5-(2-Amino-6-oxo-1,6-dihydro-purin-...)
Show SMILES CC(C)(CCn1cnc2c1nc(N)[nH]c2=O)CCP(O)(O)=O
Show InChI InChI=1S/C12H20N5O4P/c1-12(2,4-6-22(19,20)21)3-5-17-7-14-8-9(17)15-11(13)16-10(8)18/h7H,3-6H2,1-2H3,(H2,19,20,21)(H3,13,15,16,18)
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45n/an/an/an/an/an/an/an/a



Southern Research Institute

Curated by ChEMBL


Assay Description
Tested for its ability to inhibit calf spleen purine nucleoside phosphorylase (PNP)


J Med Chem 37: 2477-80 (1994)


BindingDB Entry DOI: 10.7270/Q21G0K9T
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Rattus norvegicus)
BDBM50022243
PNG
(2,8-Diamino-1,9-dihydro-purin-6-one | 8-AMINOGUANI...)
Show SMILES Nc1nc2nc(N)[nH]c(=O)c2[nH]1
Show InChI InChI=1S/C5H6N6O/c6-4-8-1-2(9-4)10-5(7)11-3(1)12/h(H6,6,7,8,9,10,11,12)
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100n/an/an/an/an/an/an/an/a



Southern Research Institute

Curated by ChEMBL


Assay Description
Tested for its ability to inhibit calf spleen purine nucleoside phosphorylase (PNP)


J Med Chem 37: 2477-80 (1994)


BindingDB Entry DOI: 10.7270/Q21G0K9T
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Rattus norvegicus)
BDBM50039559
PNG
(CHEMBL267803 | [5-(2-Amino-6-oxo-1,6-dihydro-purin...)
Show SMILES Nc1nc2n(CCCCCP(O)(O)=O)cnc2c(=O)[nH]1
Show InChI InChI=1S/C10H16N5O4P/c11-10-13-8-7(9(16)14-10)12-6-15(8)4-2-1-3-5-20(17,18)19/h6H,1-5H2,(H2,17,18,19)(H3,11,13,14,16)
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170n/an/an/an/an/an/an/an/a



Southern Research Institute

Curated by ChEMBL


Assay Description
Tested for its ability to inhibit calf spleen purine nucleoside phosphorylase (PNP)


J Med Chem 37: 2477-80 (1994)


BindingDB Entry DOI: 10.7270/Q21G0K9T
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Rattus norvegicus)
BDBM50005799
PNG
(2,8-Diamino-9-benzyl-1,9-dihydro-purin-6-one | CHE...)
Show SMILES Nc1nc2c(nc(N)[nH]c2=O)n1Cc1ccccc1
Show InChI InChI=1S/C12H12N6O/c13-11-16-9-8(10(19)17-11)15-12(14)18(9)6-7-4-2-1-3-5-7/h1-5H,6H2,(H2,14,15)(H3,13,16,17,19)
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200n/an/an/an/an/an/an/an/a



Southern Research Institute

Curated by ChEMBL


Assay Description
Tested for its ability to inhibit calf spleen purine nucleoside phosphorylase (PNP)


J Med Chem 37: 2477-80 (1994)


BindingDB Entry DOI: 10.7270/Q21G0K9T
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Rattus norvegicus)
BDBM50039552
PNG
(CHEMBL267312 | [3,3-Dimethyl-5-(6-oxo-1,6-dihydro-...)
Show SMILES CC(C)(CCn1cnc2c1nc[nH]c2=O)CCP(O)(O)=O
Show InChI InChI=1S/C12H19N4O4P/c1-12(2,4-6-21(18,19)20)3-5-16-8-15-9-10(16)13-7-14-11(9)17/h7-8H,3-6H2,1-2H3,(H,13,14,17)(H2,18,19,20)
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210n/an/an/an/an/an/an/an/a



Southern Research Institute

Curated by ChEMBL


Assay Description
Tested for its ability to inhibit calf spleen purine nucleoside phosphorylase (PNP)


J Med Chem 37: 2477-80 (1994)


BindingDB Entry DOI: 10.7270/Q21G0K9T
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Rattus norvegicus)
BDBM50039555
PNG
(CHEMBL13130 | [5-(6-Oxo-1,6-dihydro-purin-9-yl)-pe...)
Show SMILES OP(O)(=O)CCCCCn1cnc2c1nc[nH]c2=O
Show InChI InChI=1S/C10H15N4O4P/c15-10-8-9(11-6-12-10)14(7-13-8)4-2-1-3-5-19(16,17)18/h6-7H,1-5H2,(H,11,12,15)(H2,16,17,18)
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1.00E+3n/an/an/an/an/an/an/an/a



Southern Research Institute

Curated by ChEMBL


Assay Description
Tested for its ability to inhibit calf spleen purine nucleoside phosphorylase (PNP)


J Med Chem 37: 2477-80 (1994)


BindingDB Entry DOI: 10.7270/Q21G0K9T
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Rattus norvegicus)
BDBM50200094
PNG
(2-amino-1,9-dihydro-6H-purin-6-one | CHEMBL219568 ...)
Show SMILES Nc1nc2nc[nH]c2c(=O)[nH]1
Show InChI InChI=1S/C5H5N5O/c6-5-9-3-2(4(11)10-5)7-1-8-3/h1H,(H4,6,7,8,9,10,11)
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5.00E+3n/an/an/an/an/an/an/an/a



Southern Research Institute

Curated by ChEMBL


Assay Description
Tested for its ability to inhibit calf spleen purine nucleoside phosphorylase (PNP)


J Med Chem 37: 2477-80 (1994)


BindingDB Entry DOI: 10.7270/Q21G0K9T
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Rattus norvegicus)
BDBM50039554
PNG
(8-Amino-1,7-dihydro-purin-6-one | CHEMBL83601)
Show SMILES Nc1nc2nc[nH]c(=O)c2[nH]1
Show InChI InChI=1S/C5H5N5O/c6-5-9-2-3(10-5)7-1-8-4(2)11/h1H,(H4,6,7,8,9,10,11)
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1.00E+4n/an/an/an/an/an/an/an/a



Southern Research Institute

Curated by ChEMBL


Assay Description
Tested for its ability to inhibit calf spleen purine nucleoside phosphorylase (PNP)


J Med Chem 37: 2477-80 (1994)


BindingDB Entry DOI: 10.7270/Q21G0K9T
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Rattus norvegicus)
BDBM82018
PNG
(CAS_790 | CHEMBL1427 | Hypoxanthine | NSC_790)
Show SMILES O=c1[nH]cnc2nc[nH]c12
Show InChI InChI=1S/C5H2N4O/c10-5-3-4(7-1-6-3)8-2-9-5/h1-2H
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1.70E+4n/an/an/an/an/an/an/an/a



Southern Research Institute

Curated by ChEMBL


Assay Description
Tested for its ability to inhibit calf spleen purine nucleoside phosphorylase (PNP)


J Med Chem 37: 2477-80 (1994)


BindingDB Entry DOI: 10.7270/Q21G0K9T
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Purine nucleoside phosphorylase


(Rattus norvegicus)
BDBM21868
PNG
(2-amino-9-(4-hydroxybutyl)-6,9-dihydro-3H-purin-6-...)
Show SMILES Nc1nc2n(CCCCO)cnc2c(=O)[nH]1
Show InChI InChI=1S/C9H13N5O2/c10-9-12-7-6(8(16)13-9)11-5-14(7)3-1-2-4-15/h5,15H,1-4H2,(H3,10,12,13,16)
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7.70E+4n/an/an/an/an/an/an/an/a



Southern Research Institute

Curated by ChEMBL


Assay Description
Tested for its ability to inhibit calf spleen purine nucleoside phosphorylase (PNP)


J Med Chem 37: 2477-80 (1994)


BindingDB Entry DOI: 10.7270/Q21G0K9T
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Rattus norvegicus)
BDBM50039550
PNG
(9-(2-Amino-3,4-dihydroxy-butyl)-1,9-dihydro-purin-...)
Show SMILES NC(Cn1cnc2c1nc[nH]c2=O)C(O)CO
Show InChI InChI=1S/C9H13N5O3/c10-5(6(16)2-15)1-14-4-13-7-8(14)11-3-12-9(7)17/h3-6,15-16H,1-2,10H2,(H,11,12,17)
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>1.00E+5n/an/an/an/an/an/an/an/a



Southern Research Institute

Curated by ChEMBL


Assay Description
Tested for its ability to inhibit calf spleen purine nucleoside phosphorylase (PNP)


J Med Chem 37: 2477-80 (1994)


BindingDB Entry DOI: 10.7270/Q21G0K9T
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Rattus norvegicus)
BDBM50039543
PNG
(8-Amino-9-benzyl-1,9-dihydro-purin-6-one | CHEMBL8...)
Show SMILES Nc1nc2c(nc[nH]c2=O)n1Cc1ccccc1
Show InChI InChI=1S/C12H11N5O/c13-12-16-9-10(14-7-15-11(9)18)17(12)6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H2,13,16)(H,14,15,18)
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1.50E+5n/an/an/an/an/an/an/an/a



Southern Research Institute

Curated by ChEMBL


Assay Description
Tested for its ability to inhibit calf spleen purine nucleoside phosphorylase (PNP)


J Med Chem 37: 2477-80 (1994)


BindingDB Entry DOI: 10.7270/Q21G0K9T
More data for this
Ligand-Target Pair
Purine nucleoside phosphorylase


(Rattus norvegicus)
BDBM50039560
PNG
(9-(4-Hydroxy-butyl)-1,9-dihydro-purin-6-one | CHEM...)
Show SMILES OCCCCn1cnc2c1nc[nH]c2=O
Show InChI InChI=1S/C9H12N4O2/c14-4-2-1-3-13-6-12-7-8(13)10-5-11-9(7)15/h5-6,14H,1-4H2,(H,10,11,15)
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>2.00E+5n/an/an/an/an/an/an/an/a



Southern Research Institute

Curated by ChEMBL


Assay Description
Tested for its ability to inhibit calf spleen purine nucleoside phosphorylase (PNP)


J Med Chem 37: 2477-80 (1994)


BindingDB Entry DOI: 10.7270/Q21G0K9T
More data for this
Ligand-Target Pair