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Compile Data Set for Download or QSAR

Found 28 hits Enz. Inhib. hit(s) with Target = 'Phosphopantetheine adenylyltransferase (PPAT)' AND taxid = 83333   
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
Phosphopantetheine adenylyltransferase (PPAT)


(Escherichia coli)
BDBM82156
PNG
(7-substituted pyrazoloquinolone, 15)
Show SMILES CC(C)Sc1ccc2nc3cc([nH]n3c(=O)c2c1)C(O)=O
Show InChI InChI=1S/C14H13N3O3S/c1-7(2)21-8-3-4-10-9(5-8)13(18)17-12(15-10)6-11(16-17)14(19)20/h3-7,16H,1-2H3,(H,19,20)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents


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AffyNet 
Article
PubMed
n/an/a 5.00E+3n/an/an/an/an/an/a



Pfizer, Inc.



Assay Description
The reverse assay was performed in polyproplene 96-well plates containing in each well either 1 uL DMSO, 1 UL of variable concentrations of test comp...


Chem Biol Drug Des 75: 444-54 (2010)

More data for this
Ligand-Target Pair
Phosphopantetheine adenylyltransferase (PPAT)


(Escherichia coli)
BDBM82152
PNG
(7-substituted pyrazoloquinolone, 11)
Show SMILES OC(=O)c1cc2nc3ccc(I)cc3c(=O)n2[nH]1
Show InChI InChI=1S/C11H6IN3O3/c12-5-1-2-7-6(3-5)10(16)15-9(13-7)4-8(14-15)11(17)18/h1-4,14H,(H,17,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 5.10E+3n/an/an/an/an/an/a



Pfizer, Inc.



Assay Description
PPAT screening assay (forward-direction assay) were performed in clear 384 well plates containing in each well either 1-uL DMSO, 1 uL of variable con...


Chem Biol Drug Des 75: 444-54 (2010)

More data for this
Ligand-Target Pair
Phosphopantetheine adenylyltransferase (PPAT)


(Escherichia coli)
BDBM82151
PNG
(7-substituted pyrazoloquinolone, 10)
Show SMILES OC(=O)c1cc2nc3ccc(Br)cc3c(=O)n2[nH]1
Show InChI InChI=1S/C11H6BrN3O3/c12-5-1-2-7-6(3-5)10(16)15-9(13-7)4-8(14-15)11(17)18/h1-4,14H,(H,17,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 6.20E+3n/an/an/an/an/an/a



Pfizer, Inc.



Assay Description
PPAT screening assay (forward-direction assay) were performed in clear 384 well plates containing in each well either 1-uL DMSO, 1 uL of variable con...


Chem Biol Drug Des 75: 444-54 (2010)

More data for this
Ligand-Target Pair
Phosphopantetheine adenylyltransferase (PPAT)


(Escherichia coli)
BDBM82157
PNG
(7-substituted pyrazoloquinolone, 16)
Show SMILES CN(C)c1ccc2nc3cc([nH]n3c(=O)c2c1)C(O)=O
Show InChI InChI=1S/C13H12N4O3/c1-16(2)7-3-4-9-8(5-7)12(18)17-11(14-9)6-10(15-17)13(19)20/h3-6,15H,1-2H3,(H,19,20)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 7.10E+3n/an/an/an/an/an/a



Pfizer, Inc.



Assay Description
The reverse assay was performed in polyproplene 96-well plates containing in each well either 1 uL DMSO, 1 UL of variable concentrations of test comp...


Chem Biol Drug Des 75: 444-54 (2010)

More data for this
Ligand-Target Pair
Phosphopantetheine adenylyltransferase (PPAT)


(Escherichia coli)
BDBM82153
PNG
(7-substituted pyrazoloquinolone, 12)
Show SMILES CSc1ccc2nc3cc([nH]n3c(=O)c2c1)C(O)=O
Show InChI InChI=1S/C12H9N3O3S/c1-19-6-2-3-8-7(4-6)11(16)15-10(13-8)5-9(14-15)12(17)18/h2-5,14H,1H3,(H,17,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents


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AffyNet 
Article
PubMed
n/an/a 8.80E+3n/an/an/an/an/an/a



Pfizer, Inc.



Assay Description
The reverse assay was performed in polyproplene 96-well plates containing in each well either 1 uL DMSO, 1 UL of variable concentrations of test comp...


Chem Biol Drug Des 75: 444-54 (2010)

More data for this
Ligand-Target Pair
Phosphopantetheine adenylyltransferase (PPAT)


(Escherichia coli)
BDBM82152
PNG
(7-substituted pyrazoloquinolone, 11)
Show SMILES OC(=O)c1cc2nc3ccc(I)cc3c(=O)n2[nH]1
Show InChI InChI=1S/C11H6IN3O3/c12-5-1-2-7-6(3-5)10(16)15-9(13-7)4-8(14-15)11(17)18/h1-4,14H,(H,17,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 1.10E+4n/an/an/an/an/an/a



Pfizer, Inc.



Assay Description
The reverse assay was performed in polyproplene 96-well plates containing in each well either 1 uL DMSO, 1 UL of variable concentrations of test comp...


Chem Biol Drug Des 75: 444-54 (2010)

More data for this
Ligand-Target Pair
Phosphopantetheine adenylyltransferase (PPAT)


(Escherichia coli)
BDBM82153
PNG
(7-substituted pyrazoloquinolone, 12)
Show SMILES CSc1ccc2nc3cc([nH]n3c(=O)c2c1)C(O)=O
Show InChI InChI=1S/C12H9N3O3S/c1-19-6-2-3-8-7(4-6)11(16)15-10(13-8)5-9(14-15)12(17)18/h2-5,14H,1H3,(H,17,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents


Similars

AffyNet 
Article
PubMed
n/an/a 1.30E+4n/an/an/an/an/an/a



Pfizer, Inc.



Assay Description
PPAT screening assay (forward-direction assay) were performed in clear 384 well plates containing in each well either 1-uL DMSO, 1 uL of variable con...


Chem Biol Drug Des 75: 444-54 (2010)

More data for this
Ligand-Target Pair
Phosphopantetheine adenylyltransferase (PPAT)


(Escherichia coli)
BDBM82156
PNG
(7-substituted pyrazoloquinolone, 15)
Show SMILES CC(C)Sc1ccc2nc3cc([nH]n3c(=O)c2c1)C(O)=O
Show InChI InChI=1S/C14H13N3O3S/c1-7(2)21-8-3-4-10-9(5-8)13(18)17-12(15-10)6-11(16-17)14(19)20/h3-7,16H,1-2H3,(H,19,20)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents


Similars

AffyNet 
Article
PubMed
n/an/a 1.40E+4n/an/an/an/an/an/a



Pfizer, Inc.



Assay Description
PPAT screening assay (forward-direction assay) were performed in clear 384 well plates containing in each well either 1-uL DMSO, 1 uL of variable con...


Chem Biol Drug Des 75: 444-54 (2010)

More data for this
Ligand-Target Pair
Phosphopantetheine adenylyltransferase (PPAT)


(Escherichia coli)
BDBM82160
PNG
(6-substituted pyrazoloquinolone, 19)
Show SMILES Cc1ccc2c(c1)nc1cc([nH]n1c2=O)C(O)=O
Show InChI InChI=1S/C12H9N3O3/c1-6-2-3-7-8(4-6)13-10-5-9(12(17)18)14-15(10)11(7)16/h2-5,14H,1H3,(H,17,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 1.50E+4n/an/an/an/an/an/a



Pfizer, Inc.



Assay Description
PPAT screening assay (forward-direction assay) were performed in clear 384 well plates containing in each well either 1-uL DMSO, 1 uL of variable con...


Chem Biol Drug Des 75: 444-54 (2010)

More data for this
Ligand-Target Pair
Phosphopantetheine adenylyltransferase (PPAT)


(Escherichia coli)
BDBM82149
PNG
(7-substituted pyrazoloquinolone, 8)
Show SMILES OC(=O)c1cc2nc3ccc(Cl)cc3c(=O)n2[nH]1
Show InChI InChI=1S/C11H6ClN3O3/c12-5-1-2-7-6(3-5)10(16)15-9(13-7)4-8(14-15)11(17)18/h1-4,14H,(H,17,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 1.70E+4n/an/an/an/an/an/a



Pfizer, Inc.



Assay Description
PPAT screening assay (forward-direction assay) were performed in clear 384 well plates containing in each well either 1-uL DMSO, 1 uL of variable con...


Chem Biol Drug Des 75: 444-54 (2010)

More data for this
Ligand-Target Pair
Phosphopantetheine adenylyltransferase (PPAT)


(Escherichia coli)
BDBM82151
PNG
(7-substituted pyrazoloquinolone, 10)
Show SMILES OC(=O)c1cc2nc3ccc(Br)cc3c(=O)n2[nH]1
Show InChI InChI=1S/C11H6BrN3O3/c12-5-1-2-7-6(3-5)10(16)15-9(13-7)4-8(14-15)11(17)18/h1-4,14H,(H,17,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 2.20E+4n/an/an/an/an/an/a



Pfizer, Inc.



Assay Description
The reverse assay was performed in polyproplene 96-well plates containing in each well either 1 uL DMSO, 1 UL of variable concentrations of test comp...


Chem Biol Drug Des 75: 444-54 (2010)

More data for this
Ligand-Target Pair
Phosphopantetheine adenylyltransferase (PPAT)


(Escherichia coli)
BDBM82157
PNG
(7-substituted pyrazoloquinolone, 16)
Show SMILES CN(C)c1ccc2nc3cc([nH]n3c(=O)c2c1)C(O)=O
Show InChI InChI=1S/C13H12N4O3/c1-16(2)7-3-4-9-8(5-7)12(18)17-11(14-9)6-10(15-17)13(19)20/h3-6,15H,1-2H3,(H,19,20)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 4.90E+4n/an/an/an/an/an/a



Pfizer, Inc.



Assay Description
PPAT screening assay (forward-direction assay) were performed in clear 384 well plates containing in each well either 1-uL DMSO, 1 uL of variable con...


Chem Biol Drug Des 75: 444-54 (2010)

More data for this
Ligand-Target Pair
Phosphopantetheine adenylyltransferase (PPAT)


(Escherichia coli)
BDBM82164
PNG
(6-substituted pyrazoloquinolone, 23)
Show SMILES OC(=O)c1cc2nc3cc(Cl)ccc3c(=O)n2[nH]1
Show InChI InChI=1S/C11H6ClN3O3/c12-5-1-2-6-7(3-5)13-9-4-8(11(17)18)14-15(9)10(6)16/h1-4,14H,(H,17,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 4.90E+4n/an/an/an/an/an/a



Pfizer, Inc.



Assay Description
PPAT screening assay (forward-direction assay) were performed in clear 384 well plates containing in each well either 1-uL DMSO, 1 uL of variable con...


Chem Biol Drug Des 75: 444-54 (2010)

More data for this
Ligand-Target Pair
Phosphopantetheine adenylyltransferase (PPAT)


(Escherichia coli)
BDBM82161
PNG
(6-substituted pyrazoloquinolone, 20)
Show SMILES OC(=O)c1cc2nc3cc(ccc3c(=O)n2[nH]1)C(F)(F)F
Show InChI InChI=1S/C12H6F3N3O3/c13-12(14,15)5-1-2-6-7(3-5)16-9-4-8(11(20)21)17-18(9)10(6)19/h1-4,17H,(H,20,21)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 5.40E+4n/an/an/an/an/an/a



Pfizer, Inc.



Assay Description
PPAT screening assay (forward-direction assay) were performed in clear 384 well plates containing in each well either 1-uL DMSO, 1 uL of variable con...


Chem Biol Drug Des 75: 444-54 (2010)

More data for this
Ligand-Target Pair
Phosphopantetheine adenylyltransferase (PPAT)


(Escherichia coli)
BDBM82155
PNG
(7-substituted pyrazoloquinolone, 14)
Show SMILES CS(=O)(=O)c1ccc2nc3cc([nH]n3c(=O)c2c1)C(O)=O
Show InChI InChI=1S/C12H9N3O5S/c1-21(19,20)6-2-3-8-7(4-6)11(16)15-10(13-8)5-9(14-15)12(17)18/h2-5,14H,1H3,(H,17,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 9.20E+4n/an/an/an/an/an/a



Pfizer, Inc.



Assay Description
PPAT screening assay (forward-direction assay) were performed in clear 384 well plates containing in each well either 1-uL DMSO, 1 uL of variable con...


Chem Biol Drug Des 75: 444-54 (2010)

More data for this
Ligand-Target Pair
Phosphopantetheine adenylyltransferase (PPAT)


(Escherichia coli)
BDBM82164
PNG
(6-substituted pyrazoloquinolone, 23)
Show SMILES OC(=O)c1cc2nc3cc(Cl)ccc3c(=O)n2[nH]1
Show InChI InChI=1S/C11H6ClN3O3/c12-5-1-2-6-7(3-5)13-9-4-8(11(17)18)14-15(9)10(6)16/h1-4,14H,(H,17,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 9.30E+4n/an/an/an/an/an/a



Pfizer, Inc.



Assay Description
The reverse assay was performed in polyproplene 96-well plates containing in each well either 1 uL DMSO, 1 UL of variable concentrations of test comp...


Chem Biol Drug Des 75: 444-54 (2010)

More data for this
Ligand-Target Pair
Phosphopantetheine adenylyltransferase (PPAT)


(Escherichia coli)
BDBM82150
PNG
(7-substituted pyrazoloquinolone, 9)
Show SMILES OC(=O)c1cc2nc3ccc(F)cc3c(=O)n2[nH]1
Show InChI InChI=1S/C11H6FN3O3/c12-5-1-2-7-6(3-5)10(16)15-9(13-7)4-8(14-15)11(17)18/h1-4,14H,(H,17,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents


Similars

AffyNet 
Article
PubMed
n/an/a 1.03E+5n/an/an/an/an/an/a



Pfizer, Inc.



Assay Description
PPAT screening assay (forward-direction assay) were performed in clear 384 well plates containing in each well either 1-uL DMSO, 1 uL of variable con...


Chem Biol Drug Des 75: 444-54 (2010)

More data for this
Ligand-Target Pair
Phosphopantetheine adenylyltransferase (PPAT)


(Escherichia coli)
BDBM82165
PNG
(3-substituted pyrazoloquinolone, 24)
Show SMILES Cc1c([nH]n2c1nc1cc(Cl)ccc1c2=O)C(O)=O
Show InChI InChI=1S/C12H8ClN3O3/c1-5-9(12(18)19)15-16-10(5)14-8-4-6(13)2-3-7(8)11(16)17/h2-4,15H,1H3,(H,18,19)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 1.06E+5n/an/an/an/an/an/a



Pfizer, Inc.



Assay Description
PPAT screening assay (forward-direction assay) were performed in clear 384 well plates containing in each well either 1-uL DMSO, 1 uL of variable con...


Chem Biol Drug Des 75: 444-54 (2010)

More data for this
Ligand-Target Pair
Phosphopantetheine adenylyltransferase (PPAT)


(Escherichia coli)
BDBM82162
PNG
(6-substituted pyrazoloquinolone, 21)
Show SMILES Nc1ccc2c(c1)nc1cc([nH]n1c2=O)C(O)=O
Show InChI InChI=1S/C11H8N4O3/c12-5-1-2-6-7(3-5)13-9-4-8(11(17)18)14-15(9)10(6)16/h1-4,14H,12H2,(H,17,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 1.21E+5n/an/an/an/an/an/a



Pfizer, Inc.



Assay Description
PPAT screening assay (forward-direction assay) were performed in clear 384 well plates containing in each well either 1-uL DMSO, 1 uL of variable con...


Chem Biol Drug Des 75: 444-54 (2010)

More data for this
Ligand-Target Pair
Phosphopantetheine adenylyltransferase (PPAT)


(Escherichia coli)
BDBM82163
PNG
(6-substituted pyrazoloquinolone, 22)
Show SMILES OC(=O)c1cc2nc3cc(Br)ccc3c(=O)n2[nH]1
Show InChI InChI=1S/C11H6BrN3O3/c12-5-1-2-6-7(3-5)13-9-4-8(11(17)18)14-15(9)10(6)16/h1-4,14H,(H,17,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 1.24E+5n/an/an/an/an/an/a



Pfizer, Inc.



Assay Description
PPAT screening assay (forward-direction assay) were performed in clear 384 well plates containing in each well either 1-uL DMSO, 1 uL of variable con...


Chem Biol Drug Des 75: 444-54 (2010)

More data for this
Ligand-Target Pair
Phosphopantetheine adenylyltransferase (PPAT)


(Escherichia coli)
BDBM82163
PNG
(6-substituted pyrazoloquinolone, 22)
Show SMILES OC(=O)c1cc2nc3cc(Br)ccc3c(=O)n2[nH]1
Show InChI InChI=1S/C11H6BrN3O3/c12-5-1-2-6-7(3-5)13-9-4-8(11(17)18)14-15(9)10(6)16/h1-4,14H,(H,17,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a>1.25E+5n/an/an/an/an/an/a



Pfizer, Inc.



Assay Description
The reverse assay was performed in polyproplene 96-well plates containing in each well either 1 uL DMSO, 1 UL of variable concentrations of test comp...


Chem Biol Drug Des 75: 444-54 (2010)

More data for this
Ligand-Target Pair
Phosphopantetheine adenylyltransferase (PPAT)


(Escherichia coli)
BDBM82158
PNG
(7-substituted pyrazoloquinolone, 17)
Show SMILES COc1ccc2nc3cc([nH]n3c(=O)c2c1)C(O)=O
Show InChI InChI=1S/C12H9N3O4/c1-19-6-2-3-8-7(4-6)11(16)15-10(13-8)5-9(14-15)12(17)18/h2-5,14H,1H3,(H,17,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents


Similars

AffyNet 
Article
PubMed
n/an/a>1.50E+5n/an/an/an/an/an/a



Pfizer, Inc.



Assay Description
PPAT screening assay (forward-direction assay) were performed in clear 384 well plates containing in each well either 1-uL DMSO, 1 uL of variable con...


Chem Biol Drug Des 75: 444-54 (2010)

More data for this
Ligand-Target Pair
Phosphopantetheine adenylyltransferase (PPAT)


(Escherichia coli)
BDBM82159
PNG
(4-substituted pyrazoloquinolone, 18)
Show SMILES Cn1c2cc(nn2c(=O)c2cc(Cl)ccc12)C(O)=O
Show InChI InChI=1S/C12H8ClN3O3/c1-15-9-3-2-6(13)4-7(9)11(17)16-10(15)5-8(14-16)12(18)19/h2-5H,1H3,(H,18,19)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 1.60E+5n/an/an/an/an/an/a



Pfizer, Inc.



Assay Description
PPAT screening assay (forward-direction assay) were performed in clear 384 well plates containing in each well either 1-uL DMSO, 1 uL of variable con...


Chem Biol Drug Des 75: 444-54 (2010)

More data for this
Ligand-Target Pair
Phosphopantetheine adenylyltransferase (PPAT)


(Escherichia coli)
BDBM82154
PNG
(7-substituted pyrazoloquinolone, 13)
Show SMILES CS(=O)c1ccc2nc3cc([nH]n3c(=O)c2c1)C(O)=O
Show InChI InChI=1S/C12H9N3O4S/c1-20(19)6-2-3-8-7(4-6)11(16)15-10(13-8)5-9(14-15)12(17)18/h2-5,14H,1H3,(H,17,18)
PDB
MMDB

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n/an/a 1.66E+5n/an/an/an/an/an/a



Pfizer, Inc.



Assay Description
PPAT screening assay (forward-direction assay) were performed in clear 384 well plates containing in each well either 1-uL DMSO, 1 uL of variable con...


Chem Biol Drug Des 75: 444-54 (2010)

More data for this
Ligand-Target Pair
Phosphopantetheine adenylyltransferase (PPAT)


(Escherichia coli)
BDBM82161
PNG
(6-substituted pyrazoloquinolone, 20)
Show SMILES OC(=O)c1cc2nc3cc(ccc3c(=O)n2[nH]1)C(F)(F)F
Show InChI InChI=1S/C12H6F3N3O3/c13-12(14,15)5-1-2-6-7(3-5)16-9-4-8(11(20)21)17-18(9)10(6)19/h1-4,17H,(H,20,21)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

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AffyNet 
Article
PubMed
n/an/a 2.00E+5n/an/an/an/an/an/a



Pfizer, Inc.



Assay Description
The reverse assay was performed in polyproplene 96-well plates containing in each well either 1 uL DMSO, 1 UL of variable concentrations of test comp...


Chem Biol Drug Des 75: 444-54 (2010)

More data for this
Ligand-Target Pair
Phosphopantetheine adenylyltransferase (PPAT)


(Escherichia coli)
BDBM82147
PNG
(7-substituted pyrazoloquinolone, 6)
Show SMILES OC(=O)c1cc2nc3ccccc3c(=O)n2[nH]1
Show InChI InChI=1S/C11H7N3O3/c15-10-6-3-1-2-4-7(6)12-9-5-8(11(16)17)13-14(9)10/h1-5,13H,(H,16,17)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents


Similars

AffyNet 
Article
PubMed
n/an/a>2.30E+5n/an/an/an/an/an/a



Pfizer, Inc.



Assay Description
The reverse assay was performed in polyproplene 96-well plates containing in each well either 1 uL DMSO, 1 UL of variable concentrations of test comp...


Chem Biol Drug Des 75: 444-54 (2010)

More data for this
Ligand-Target Pair
Phosphopantetheine adenylyltransferase (PPAT)


(Escherichia coli)
BDBM82148
PNG
(7-substituted pyrazoloquinolone, 7)
Show SMILES Cc1ccc2nc3cc([nH]n3c(=O)c2c1)C(O)=O
Show InChI InChI=1S/C12H9N3O3/c1-6-2-3-8-7(4-6)11(16)15-10(13-8)5-9(14-15)12(17)18/h2-5,14H,1H3,(H,17,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 2.44E+5n/an/an/an/an/an/a



Pfizer, Inc.



Assay Description
PPAT screening assay (forward-direction assay) were performed in clear 384 well plates containing in each well either 1-uL DMSO, 1 uL of variable con...


Chem Biol Drug Des 75: 444-54 (2010)

More data for this
Ligand-Target Pair
Phosphopantetheine adenylyltransferase (PPAT)


(Escherichia coli)
BDBM82147
PNG
(7-substituted pyrazoloquinolone, 6)
Show SMILES OC(=O)c1cc2nc3ccccc3c(=O)n2[nH]1
Show InChI InChI=1S/C11H7N3O3/c15-10-6-3-1-2-4-7(6)12-9-5-8(11(16)17)13-14(9)10/h1-5,13H,(H,16,17)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents


Similars

AffyNet 
Article
PubMed
n/an/a 2.53E+5n/an/an/an/an/an/a



Pfizer, Inc.



Assay Description
PPAT screening assay (forward-direction assay) were performed in clear 384 well plates containing in each well either 1-uL DMSO, 1 uL of variable con...


Chem Biol Drug Des 75: 444-54 (2010)

More data for this
Ligand-Target Pair