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Found 23 hits Enz. Inhib. hit(s) with Target = 'Phospholipase D (PLD_sp)'   
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
Phospholipase D (PLD_sp)


(Streptomyces sp. PMF)
BDBM123745
PNG
(1-(4-methoxyphenyl)-3-(naphthalen-1-yl)-1H-pyrazol...)
Show SMILES COc1ccc(cc1)-n1nc(-c2cccc3ccccc23)c2c(N)ncnc12
Show InChI InChI=1S/C22H17N5O/c1-28-16-11-9-15(10-12-16)27-22-19(21(23)24-13-25-22)20(26-27)18-8-4-6-14-5-2-3-7-17(14)18/h2-13H,1H3,(H2,23,24,25)
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PubMed
n/an/a 10n/an/an/an/an/a37



University of Massachusetts Boston



Assay Description
PLD enzymes (50 nM) were reconstituted with phospholipid vesicle substrates. All assays were performed at 37 C with agitation for 30 min. Reactions...


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase D (PLD_sp)


(Streptomyces sp. PMF)
BDBM50257541
PNG
((1R,2R)-N-([S]-1-{4-[5-bromo-2-oxo-2,3-dihydro-1H-...)
Show SMILES C[C@@H](CN1CCC(CC1)n1c2ccc(Br)cc2[nH]c1=O)NC(=O)[C@@H]1C[C@H]1c1ccccc1
Show InChI InChI=1S/C25H29BrN4O2/c1-16(27-24(31)21-14-20(21)17-5-3-2-4-6-17)15-29-11-9-19(10-12-29)30-23-8-7-18(26)13-22(23)28-25(30)32/h2-8,13,16,19-21H,9-12,14-15H2,1H3,(H,27,31)(H,28,32)/t16-,20-,21+/m0/s1
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PubMed
n/an/a 50n/an/an/an/an/a37



University of Massachusetts Boston



Assay Description
PLD enzymes (50 nM) were reconstituted with phospholipid vesicle substrates. All assays were performed at 37 C with agitation for 30 min. Reactions...


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase D (PLD_sp)


(Streptomyces sp. PMF)
BDBM123744
PNG
(5-Fluoro-N-(2-(4-(2-Oxo-2,3-dihydro-1H-benzo[d]imi...)
Show SMILES Fc1ccc2[nH]c(cc2c1)C(=O)NCCN1CCC(CC1)n1c2ccccc2[nH]c1=O
Show InChI InChI=1S/C23H24FN5O2/c24-16-5-6-18-15(13-16)14-20(26-18)22(30)25-9-12-28-10-7-17(8-11-28)29-21-4-2-1-3-19(21)27-23(29)31/h1-6,13-14,17,26H,7-12H2,(H,25,30)(H,27,31)
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n/an/a 100n/an/an/an/an/a37



University of Massachusetts Boston



Assay Description
PLD enzymes (50 nM) were reconstituted with phospholipid vesicle substrates. All assays were performed at 37 C with agitation for 30 min. Reactions...


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase D (PLD_sp)


(Streptomyces sp. PMF)
BDBM87245
PNG
(CHEMBL492797 | ML272 | N-(2-(4-(2-Oxo-2,3-dihydro-...)
Show SMILES O=C(NCCN1CCC(CC1)n1c2ccccc2[nH]c1=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C25H26N4O2/c30-24(20-10-9-18-5-1-2-6-19(18)17-20)26-13-16-28-14-11-21(12-15-28)29-23-8-4-3-7-22(23)27-25(29)31/h1-10,17,21H,11-16H2,(H,26,30)(H,27,31)
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n/an/a 125n/an/an/an/an/a37



University of Massachusetts Boston



Assay Description
PLD enzymes (50 nM) were reconstituted with phospholipid vesicle substrates. All assays were performed at 37 C with agitation for 30 min. Reactions...


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase D (PLD_sp)


(Streptomyces sp. PMF)
BDBM123746
PNG
(1-(4-methoxyphenyl)-3-phenyl-1H-pyrazolo[3,4-d]pyr...)
Show SMILES COc1ccc(cc1)-n1nc(-c2ccccc2)c2c(N)ncnc12
Show InChI InChI=1S/C18H15N5O/c1-24-14-9-7-13(8-10-14)23-18-15(17(19)20-11-21-18)16(22-23)12-5-3-2-4-6-12/h2-11H,1H3,(H2,19,20,21)
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PubMed
n/an/a 275n/an/an/an/an/a37



University of Massachusetts Boston



Assay Description
PLD enzymes (50 nM) were reconstituted with phospholipid vesicle substrates. All assays were performed at 37 C with agitation for 30 min. Reactions...


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase D (PLD_sp)


(Streptomyces sp. PMF)
BDBM123751
PNG
(1-(2-ethylphenyl)-3-(naphthalen-2-yl)-1H-pyrazolo[...)
Show SMILES CCc1ccccc1-n1nc(-c2ccc3ccccc3c2)c2c(N)ncnc12
Show InChI InChI=1S/C23H19N5/c1-2-15-7-5-6-10-19(15)28-23-20(22(24)25-14-26-23)21(27-28)18-12-11-16-8-3-4-9-17(16)13-18/h3-14H,2H2,1H3,(H2,24,25,26)
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PubMed
n/an/a 355n/an/an/an/an/a37



University of Massachusetts Boston



Assay Description
PLD enzymes (50 nM) were reconstituted with phospholipid vesicle substrates. All assays were performed at 37 C with agitation for 30 min. Reactions...


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase D (PLD_sp)


(Streptomyces sp. PMF)
BDBM50345704
PNG
(1-(tert-butyl)-3-(naphthalen-2-yl)-1H-pyrazolo[3,4...)
Show SMILES CC(C)(C)n1nc(-c2ccc3ccccc3c2)c2c(N)ncnc12
Show InChI InChI=1S/C19H19N5/c1-19(2,3)24-18-15(17(20)21-11-22-18)16(23-24)14-9-8-12-6-4-5-7-13(12)10-14/h4-11H,1-3H3,(H2,20,21,22)
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PubMed
n/an/a 375n/an/an/an/an/a37



University of Massachusetts Boston



Assay Description
PLD enzymes (50 nM) were reconstituted with phospholipid vesicle substrates. All assays were performed at 37 C with agitation for 30 min. Reactions...


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase D (PLD_sp)


(Streptomyces sp. PMF)
BDBM50229961
PNG
(1-(1,1-dimethylethyl)-3-(1-naphthalenyl)-1H-pyrazo...)
Show SMILES CC(C)(C)n1nc(-c2cccc3ccccc23)c2c(N)ncnc12
Show InChI InChI=1S/C19H19N5/c1-19(2,3)24-18-15(17(20)21-11-22-18)16(23-24)14-10-6-8-12-7-4-5-9-13(12)14/h4-11H,1-3H3,(H2,20,21,22)
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n/an/a 385n/an/an/an/an/a37



University of Massachusetts Boston



Assay Description
PLD enzymes (50 nM) were reconstituted with phospholipid vesicle substrates. All assays were performed at 37 C with agitation for 30 min. Reactions...


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase D (PLD_sp)


(Streptomyces sp. PMF)
BDBM123749
PNG
(1-(2-ethylphenyl)-3-(naphthalen-1-yl)-1H-pyrazolo[...)
Show SMILES CCc1ccccc1-n1nc(-c2cccc3ccccc23)c2c(N)ncnc12
Show InChI InChI=1S/C23H19N5/c1-2-15-8-4-6-13-19(15)28-23-20(22(24)25-14-26-23)21(27-28)18-12-7-10-16-9-3-5-11-17(16)18/h3-14H,2H2,1H3,(H2,24,25,26)
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PubMed
n/an/a 390n/an/an/an/an/a37



University of Massachusetts Boston



Assay Description
PLD enzymes (50 nM) were reconstituted with phospholipid vesicle substrates. All assays were performed at 37 C with agitation for 30 min. Reactions...


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase D (PLD_sp)


(Streptomyces sp. PMF)
BDBM123750
PNG
(1-(2-ethylphenyl)-3-phenyl-1H-pyrazolo[3,4-d]pyrim...)
Show SMILES CCc1ccccc1-n1nc(-c2ccccc2)c2c(N)ncnc12
Show InChI InChI=1S/C19H17N5/c1-2-13-8-6-7-11-15(13)24-19-16(18(20)21-12-22-19)17(23-24)14-9-4-3-5-10-14/h3-12H,2H2,1H3,(H2,20,21,22)
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PubMed
n/an/a 450n/an/an/an/an/a37



University of Massachusetts Boston



Assay Description
PLD enzymes (50 nM) were reconstituted with phospholipid vesicle substrates. All assays were performed at 37 C with agitation for 30 min. Reactions...


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase D (PLD_sp)


(Streptomyces sp. PMF)
BDBM123752
PNG
(3‐(naphthalen‐1‐yl)‐1̴...)
Show SMILES Nc1ncnc2n(nc(-c3cccc4ccccc34)c12)-c1ccccc1
Show InChI InChI=1S/C21H15N5/c22-20-18-19(17-12-6-8-14-7-4-5-11-16(14)17)25-26(21(18)24-13-23-20)15-9-2-1-3-10-15/h1-13H,(H2,22,23,24)
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PubMed
n/an/a 545n/an/an/an/an/a37



University of Massachusetts Boston



Assay Description
PLD enzymes (50 nM) were reconstituted with phospholipid vesicle substrates. All assays were performed at 37 C with agitation for 30 min. Reactions...


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase D (PLD_sp)


(Streptomyces sp. PMF)
BDBM123747
PNG
(1-(tert-butyl)-3-phenyl-1H-pyrazolo[3,4-d]pyrimidi...)
Show SMILES CC(C)(C)n1nc(-c2ccccc2)c2c(N)ncnc12
Show InChI InChI=1S/C15H17N5/c1-15(2,3)20-14-11(13(16)17-9-18-14)12(19-20)10-7-5-4-6-8-10/h4-9H,1-3H3,(H2,16,17,18)
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PubMed
n/an/a 650n/an/an/an/an/a37



University of Massachusetts Boston



Assay Description
PLD enzymes (50 nM) were reconstituted with phospholipid vesicle substrates. All assays were performed at 37 C with agitation for 30 min. Reactions...


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase D (PLD_sp)


(Streptomyces sp. PMF)
BDBM123756
PNG
(1-methyl-3-(naphthalen-2-yl)-1H-pyrazolo[3,4-d]pyr...)
Show SMILES Cn1nc(-c2ccc3ccccc3c2)c2c(N)ncnc12
Show InChI InChI=1S/C16H13N5/c1-21-16-13(15(17)18-9-19-16)14(20-21)12-7-6-10-4-2-3-5-11(10)8-12/h2-9H,1H3,(H2,17,18,19)
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PubMed
n/an/a 650n/an/an/an/an/a37



University of Massachusetts Boston



Assay Description
PLD enzymes (50 nM) were reconstituted with phospholipid vesicle substrates. All assays were performed at 37 C with agitation for 30 min. Reactions...


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase D (PLD_sp)


(Streptomyces sp. PMF)
BDBM123755
PNG
(1-methyl-3-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-am...)
Show SMILES Cn1nc(-c2ccccc2)c2c(N)ncnc12
Show InChI InChI=1S/C12H11N5/c1-17-12-9(11(13)14-7-15-12)10(16-17)8-5-3-2-4-6-8/h2-7H,1H3,(H2,13,14,15)
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PubMed
n/an/a 695n/an/an/an/an/a37



University of Massachusetts Boston



Assay Description
PLD enzymes (50 nM) were reconstituted with phospholipid vesicle substrates. All assays were performed at 37 C with agitation for 30 min. Reactions...


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase D (PLD_sp)


(Streptomyces sp. PMF)
BDBM3003
PNG
(1,3-diphenyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine |...)
Show SMILES Nc1ncnc2n(nc(-c3ccccc3)c12)-c1ccccc1
Show InChI InChI=1S/C17H13N5/c18-16-14-15(12-7-3-1-4-8-12)21-22(17(14)20-11-19-16)13-9-5-2-6-10-13/h1-11H,(H2,18,19,20)
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n/an/a 700n/an/an/an/an/a37



University of Massachusetts Boston



Assay Description
PLD enzymes (50 nM) were reconstituted with phospholipid vesicle substrates. All assays were performed at 37 C with agitation for 30 min. Reactions...


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase D (PLD_sp)


(Streptomyces sp. PMF)
BDBM123748
PNG
(1-(tert-butyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidi...)
Show SMILES Cc1nn(c2ncnc(N)c12)C(C)(C)C
Show InChI InChI=1S/C10H15N5/c1-6-7-8(11)12-5-13-9(7)15(14-6)10(2,3)4/h5H,1-4H3,(H2,11,12,13)
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PubMed
n/an/a 790n/an/an/an/an/a37



University of Massachusetts Boston



Assay Description
PLD enzymes (50 nM) were reconstituted with phospholipid vesicle substrates. All assays were performed at 37 C with agitation for 30 min. Reactions...


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase D (PLD_sp)


(Streptomyces sp. PMF)
BDBM123754
PNG
(1-methyl-3-(naphthalen-1-yl)-1H-pyrazolo[3,4-d]pyr...)
Show SMILES Cn1nc(-c2cccc3ccccc23)c2c(N)ncnc12
Show InChI InChI=1S/C16H13N5/c1-21-16-13(15(17)18-9-19-16)14(20-21)12-8-4-6-10-5-2-3-7-11(10)12/h2-9H,1H3,(H2,17,18,19)
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PubMed
n/an/a 800n/an/an/an/an/a37



University of Massachusetts Boston



Assay Description
PLD enzymes (50 nM) were reconstituted with phospholipid vesicle substrates. All assays were performed at 37 C with agitation for 30 min. Reactions...


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase D (PLD_sp)


(Streptomyces sp. PMF)
BDBM123757
PNG
(1,3-dimethyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine (...)
Show SMILES Cc1nn(C)c2ncnc(N)c12
Show InChI InChI=1S/C7H9N5/c1-4-5-6(8)9-3-10-7(5)12(2)11-4/h3H,1-2H3,(H2,8,9,10)
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PubMed
n/an/a 1.20E+3n/an/an/an/an/a37



University of Massachusetts Boston



Assay Description
PLD enzymes (50 nM) were reconstituted with phospholipid vesicle substrates. All assays were performed at 37 C with agitation for 30 min. Reactions...


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase D (PLD_sp)


(Streptomyces sp. PMF)
BDBM87231
PNG
(N-[2-(4-keto-1-phenyl-1,3,8-triazaspiro[4.5]decan-...)
Show SMILES O=C(NCCN1CCC2(CC1)N(CNC2=O)c1ccccc1)c1cnc2ccccc2c1
Show InChI InChI=1S/C25H27N5O2/c31-23(20-16-19-6-4-5-9-22(19)27-17-20)26-12-15-29-13-10-25(11-14-29)24(32)28-18-30(25)21-7-2-1-3-8-21/h1-9,16-17H,10-15,18H2,(H,26,31)(H,28,32)
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PubMed
n/an/a 1.23E+3n/an/an/an/an/a37



University of Massachusetts Boston



Assay Description
PLD enzymes (50 nM) were reconstituted with phospholipid vesicle substrates. All assays were performed at 37 C with agitation for 30 min. Reactions...


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase D (PLD_sp)


(Streptomyces sp. PMF)
BDBM123753
PNG
(3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-am...)
Show SMILES Cc1nn(-c2ccccc2)c2ncnc(N)c12
Show InChI InChI=1S/C12H11N5/c1-8-10-11(13)14-7-15-12(10)17(16-8)9-5-3-2-4-6-9/h2-7H,1H3,(H2,13,14,15)
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PubMed
n/an/a 1.50E+3n/an/an/an/an/a37



University of Massachusetts Boston



Assay Description
PLD enzymes (50 nM) were reconstituted with phospholipid vesicle substrates. All assays were performed at 37 C with agitation for 30 min. Reactions...


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase D (PLD_sp)


(Streptomyces sp. PMF)
BDBM123760
PNG
(3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine (19))
Show SMILES Cc1[nH]nc2ncnc(N)c12
Show InChI InChI=1S/C6H7N5/c1-3-4-5(7)8-2-9-6(4)11-10-3/h2H,1H3,(H3,7,8,9,10,11)
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PubMed
n/an/a 1.55E+3n/an/an/an/an/a37



University of Massachusetts Boston



Assay Description
PLD enzymes (50 nM) were reconstituted with phospholipid vesicle substrates. All assays were performed at 37 C with agitation for 30 min. Reactions...


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase D (PLD_sp)


(Streptomyces sp. PMF)
BDBM123759
PNG
(3‐(naphthalen‐2‐yl)‐1HR...)
Show SMILES Nc1ncnc2n[nH]c(-c3ccc4ccccc4c3)c12
Show InChI InChI=1S/C15H11N5/c16-14-12-13(19-20-15(12)18-8-17-14)11-6-5-9-3-1-2-4-10(9)7-11/h1-8H,(H3,16,17,18,19,20)
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PubMed
n/an/a 1.75E+3n/an/an/an/an/a37



University of Massachusetts Boston



Assay Description
PLD enzymes (50 nM) were reconstituted with phospholipid vesicle substrates. All assays were performed at 37 C with agitation for 30 min. Reactions...


Citation and Details
More data for this
Ligand-Target Pair
Phospholipase D (PLD_sp)


(Streptomyces sp. PMF)
BDBM123758
PNG
(3-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine (17))
Show SMILES Nc1ncnc2n[nH]c(-c3ccccc3)c12
Show InChI InChI=1S/C11H9N5/c12-10-8-9(7-4-2-1-3-5-7)15-16-11(8)14-6-13-10/h1-6H,(H3,12,13,14,15,16)
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Article
PubMed
n/an/a 1.95E+3n/an/an/an/an/a37



University of Massachusetts Boston



Assay Description
PLD enzymes (50 nM) were reconstituted with phospholipid vesicle substrates. All assays were performed at 37 C with agitation for 30 min. Reactions...


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Ligand-Target Pair