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PubChem AID 1408

Compile data set for download or QSAR
Found 30 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
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
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32337
PNG
(MLS000028832 | SMR000058536 | STAUROSPORINE | cid_...)
Show SMILES CN[C@H]1C[C@H]2O[C@@](C)([C@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13
Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20+,26-,28-/m0/s1
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n/an/a<100n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32334
PNG
(7-hydroxy-2,3,4,5-tetrahydro-1H-[1]benzofuro[2,3-c...)
Show SMILES Oc1ccc2oc3c(CCCNC3=O)c2c1
Show InChI InChI=1S/C12H11NO3/c14-7-3-4-10-9(6-7)8-2-1-5-13-12(15)11(8)16-10/h3-4,6,14H,1-2,5H2,(H,13,15)
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n/an/a 742n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32338
PNG
(4-amino-7-(3,4-dihydroxy-5-methylol-tetrahydrofura...)
Show SMILES NC(=O)c1cn(C2OC(CO)C(O)C2O)c2ncnc(N)c12
Show InChI InChI=1S/C12H15N5O5/c13-9-6-4(10(14)21)1-17(11(6)16-3-15-9)12-8(20)7(19)5(2-18)22-12/h1,3,5,7-8,12,18-20H,2H2,(H2,14,21)(H2,13,15,16)
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n/an/a 1.66E+3n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32348
PNG
(6-(2-methyl-2,3-dihydro-1H-indol-1-yl)-5-nitro-4-p...)
Show SMILES CC1Cc2ccccc2N1c1ncnc(N)c1[N+]([O-])=O
Show InChI InChI=1S/C13H13N5O2/c1-8-6-9-4-2-3-5-10(9)17(8)13-11(18(19)20)12(14)15-7-16-13/h2-5,7-8H,6H2,1H3,(H2,14,15,16)
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n/an/a 3.69E+3n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32333
PNG
((6Z)-6-[4-(3-aminopropylamino)-6-methyl-1H-pyrimid...)
Show SMILES Cc1cc(NCCCN)nc(n1)-c1ccccc1O
Show InChI InChI=1S/C14H18N4O/c1-10-9-13(16-8-4-7-15)18-14(17-10)11-5-2-3-6-12(11)19/h2-3,5-6,9,19H,4,7-8,15H2,1H3,(H,16,17,18)
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n/an/a 4.40E+3n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM16173
PNG
(3,5-diamino-6-chloro-N-(diaminomethylene)pyrazinam...)
Show SMILES NC(=N)NC(=O)c1nc(Cl)c(N)nc1N
Show InChI InChI=1S/C6H8ClN7O/c7-2-4(9)13-3(8)1(12-2)5(15)14-6(10)11/h(H4,8,9,13)(H4,10,11,14,15)
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n/an/a 6.88E+3n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32341
PNG
(5-(3-Chloro-phenyl)-furan-2-carboxylic acid (4-mor...)
Show SMILES Clc1cccc(c1)-c1ccc(o1)C(=O)Nc1ccc(CN2CCOCC2)cc1
Show InChI InChI=1S/C22H21ClN2O3/c23-18-3-1-2-17(14-18)20-8-9-21(28-20)22(26)24-19-6-4-16(5-7-19)15-25-10-12-27-13-11-25/h1-9,14H,10-13,15H2,(H,24,26)
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n/an/a 8.02E+3n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32360
PNG
((3,5-dichloro-2-pyridyl)-[1-(2-pyridyl)ethylidenea...)
Show SMILES CC(N=Nc1ncc(Cl)cc1Cl)c1ccccn1
Show InChI InChI=1S/C12H10Cl2N4/c1-8(11-4-2-3-5-15-11)17-18-12-10(14)6-9(13)7-16-12/h2-8H,1H3
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n/an/a 9.27E+3n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32342
PNG
((2-amino-6-nitro-1,3-benzothiazol-7-yl)amine | 2,7...)
Show SMILES Nc1nc2ccc(c(N)c2s1)[N+]([O-])=O
Show InChI InChI=1S/C7H6N4O2S/c8-5-4(11(12)13)2-1-3-6(5)14-7(9)10-3/h1-2H,8H2,(H2,9,10)
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n/an/a 9.62E+3n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32343
PNG
((3,5-dichloro-4-pyridyl)-(4-pyridylmethyleneamino)...)
Show SMILES Clc1cncc(Cl)c1N=NCc1ccncc1
Show InChI InChI=1S/C11H8Cl2N4/c12-9-6-15-7-10(13)11(9)17-16-5-8-1-3-14-4-2-8/h1-4,6-7H,5H2
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n/an/a 1.20E+4n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32340
PNG
(3-ethyl-6-methoxy-1H-benzo[de]cinnoline | MLS00053...)
Show SMILES CCc1n[nH]c2cccc3c(OC)ccc1c23
Show InChI InChI=1S/C14H14N2O/c1-3-11-9-7-8-13(17-2)10-5-4-6-12(14(9)10)16-15-11/h4-8,16H,3H2,1-2H3
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n/an/a 2.18E+4n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32349
PNG
(MLS000688854 | N'-(2-furanylmethyl)-N-(5-methyl-3-...)
Show SMILES Cc1cc(NC(=O)CCC(=O)N(Cc2ccco2)C(C(=O)NCC2CCCO2)c2ccncc2)no1
Show InChI InChI=1S/C25H29N5O6/c1-17-14-21(29-36-17)28-22(31)6-7-23(32)30(16-20-5-3-13-35-20)24(18-8-10-26-11-9-18)25(33)27-15-19-4-2-12-34-19/h3,5,8-11,13-14,19,24H,2,4,6-7,12,15-16H2,1H3,(H,27,33)(H,28,29,31)
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n/an/a>5.00E+4n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32350
PNG
(MLS000708313 | N-(2-pyrrolidin-1-ylcarbonylphenyl)...)
Show SMILES O=C(Nc1ccccc1C(=O)N1CCCC1)C1COc2ccccc2O1
Show InChI InChI=1S/C20H20N2O4/c23-19(18-13-25-16-9-3-4-10-17(16)26-18)21-15-8-2-1-7-14(15)20(24)22-11-5-6-12-22/h1-4,7-10,18H,5-6,11-13H2,(H,21,23)
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n/an/a>5.00E+4n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32354
PNG
(4-(cyclohexanecarbonyl)-1H-pyrrole-2-carboxylic ac...)
Show SMILES OC(=O)c1cc(c[nH]1)C(=O)C1CCCCC1
Show InChI InChI=1S/C12H15NO3/c14-11(8-4-2-1-3-5-8)9-6-10(12(15)16)13-7-9/h6-8,13H,1-5H2,(H,15,16)
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n/an/a>5.00E+4n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32359
PNG
(MLS000772778 | N-(2-naphthalenyl)-2-(pyridin-4-ylt...)
Show SMILES O=C(CSc1ccncc1)Nc1ccc2ccccc2c1
Show InChI InChI=1S/C17H14N2OS/c20-17(12-21-16-7-9-18-10-8-16)19-15-6-5-13-3-1-2-4-14(13)11-15/h1-11H,12H2,(H,19,20)
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n/an/a>5.00E+4n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32335
PNG
(MLS000087884 | N-[2-(2-methylphenyl)-2,6-dihydro-4...)
Show SMILES CCC(=O)Nc1c2CSCc2nn1-c1ccccc1C
Show InChI InChI=1S/C15H17N3OS/c1-3-14(19)16-15-11-8-20-9-12(11)17-18(15)13-7-5-4-6-10(13)2/h4-7H,3,8-9H2,1-2H3,(H,16,19)
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n/an/a>5.00E+4n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32336
PNG
((5-acetyloxy-4-methyl-2-oxidanylidene-chromen-7-yl...)
Show SMILES CC(=O)Oc1cc(OC(C)=O)c2c(C)cc(=O)oc2c1
Show InChI InChI=1S/C14H12O6/c1-7-4-13(17)20-12-6-10(18-8(2)15)5-11(14(7)12)19-9(3)16/h4-6H,1-3H3
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n/an/a>5.00E+4n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32344
PNG
(MLS000723809 | N-(4-nitrophenyl)-9-acridinamine | ...)
Show SMILES [O-][N+](=O)c1ccc(Nc2c3ccccc3nc3ccccc23)cc1
Show InChI InChI=1S/C19H13N3O2/c23-22(24)14-11-9-13(10-12-14)20-19-15-5-1-3-7-17(15)21-18-8-4-2-6-16(18)19/h1-12H,(H,20,21)
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n/an/a>5.00E+4n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32345
PNG
(MLS000391610 | N'-(2-benzo[cd]indolyl)-4-bromobenz...)
Show SMILES Brc1ccc(cc1)C(=O)NNC1=Nc2cccc3cccc1c23
Show InChI InChI=1S/C18H12BrN3O/c19-13-9-7-12(8-10-13)18(23)22-21-17-14-5-1-3-11-4-2-6-15(20-17)16(11)14/h1-10H,(H,20,21)(H,22,23)
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n/an/a>5.00E+4n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32361
PNG
(2-[4-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]buty...)
Show SMILES CCCc1cc(=O)[nH]c(SCCCCN2C(=O)c3ccccc3C2=O)n1
Show InChI InChI=1S/C19H21N3O3S/c1-2-7-13-12-16(23)21-19(20-13)26-11-6-5-10-22-17(24)14-8-3-4-9-15(14)18(22)25/h3-4,8-9,12H,2,5-7,10-11H2,1H3,(H,20,21,23)
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n/an/a>5.00E+4n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32351
PNG
(1-phenyl-2-[(3-pyridin-3-yl-[1,2,4]triazolo[4,3-b]...)
Show SMILES O=C(CSc1ccc2nnc(-c3cccnc3)n2n1)c1ccccc1
Show InChI InChI=1S/C18H13N5OS/c24-15(13-5-2-1-3-6-13)12-25-17-9-8-16-20-21-18(23(16)22-17)14-7-4-10-19-11-14/h1-11H,12H2
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n/an/a>5.00E+4n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32357
PNG
(2-(2-furoyl)-N-p-anisyl-3,4-dihydro-1H-isoquinolin...)
Show SMILES COc1ccc(CNC(=O)C2Cc3ccccc3CN2C(=O)c2ccco2)cc1
Show InChI InChI=1S/C23H22N2O4/c1-28-19-10-8-16(9-11-19)14-24-22(26)20-13-17-5-2-3-6-18(17)15-25(20)23(27)21-7-4-12-29-21/h2-12,20H,13-15H2,1H3,(H,24,26)
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University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32352
PNG
(2-(3-besylpropanoylimino)-3,4-dimethyl-4-thiazolin...)
Show SMILES CCOC(=O)c1sc(=NC(=O)CCS(=O)(=O)c2ccccc2)n(C)c1C
Show InChI InChI=1S/C17H20N2O5S2/c1-4-24-16(21)15-12(2)19(3)17(25-15)18-14(20)10-11-26(22,23)13-8-6-5-7-9-13/h5-9H,4,10-11H2,1-3H3
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University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32339
PNG
(5-Bromo-furan-2-carboxylic acid [2-(4-methanesulfo...)
Show SMILES CS(=O)(=O)N1CCN(CC1)c1ccccc1NC(=O)c1ccc(Br)o1
Show InChI InChI=1S/C16H18BrN3O4S/c1-25(22,23)20-10-8-19(9-11-20)13-5-3-2-4-12(13)18-16(21)14-6-7-15(17)24-14/h2-7H,8-11H2,1H3,(H,18,21)
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n/an/a>5.00E+4n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32358
PNG
(2-chloro-5-(1-piperidinylsulfonyl)benzoic acid [2-...)
Show SMILES Cn1cccc1C(=O)NC(=O)COC(=O)c1cc(ccc1Cl)S(=O)(=O)N1CCCCC1
Show InChI InChI=1S/C20H22ClN3O6S/c1-23-9-5-6-17(23)19(26)22-18(25)13-30-20(27)15-12-14(7-8-16(15)21)31(28,29)24-10-3-2-4-11-24/h5-9,12H,2-4,10-11,13H2,1H3,(H,22,25,26)
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University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32356
PNG
(2-amino-6-chloro-4-methyl-3,5-pyridinedicarbonitri...)
Show SMILES Cc1c(C#N)c(N)nc(Cl)c1C#N
Show InChI InChI=1S/C8H5ClN4/c1-4-5(2-10)7(9)13-8(12)6(4)3-11/h1H3,(H2,12,13)
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n/an/a>5.00E+4n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32346
PNG
(2-[(3-methoxycarbonyl-5,6,7,8-tetrahydro-4H-cycloh...)
Show SMILES COC(=O)c1c(NC(=O)C2C3CCC(C3)C2C(O)=O)sc2CCCCCc12
Show InChI InChI=1S/C20H25NO5S/c1-26-20(25)16-12-5-3-2-4-6-13(12)27-18(16)21-17(22)14-10-7-8-11(9-10)15(14)19(23)24/h10-11,14-15H,2-9H2,1H3,(H,21,22)(H,23,24)
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University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32347
PNG
(MLS000674332 | N-(4-fluorobenzyl)-2-(methylthio)be...)
Show SMILES CSc1ccccc1C(=O)NCc1ccc(F)cc1
Show InChI InChI=1S/C15H14FNOS/c1-19-14-5-3-2-4-13(14)15(18)17-10-11-6-8-12(16)9-7-11/h2-9H,10H2,1H3,(H,17,18)
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n/an/a>5.00E+4n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32353
PNG
(3-(2,5-dichlorophenyl)-1,3-thiazolan-4-one | 3-(2,...)
Show SMILES Clc1ccc(Cl)c(c1)N1CSCC1=O
Show InChI InChI=1S/C9H7Cl2NOS/c10-6-1-2-7(11)8(3-6)12-5-14-4-9(12)13/h1-3H,4-5H2
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n/an/a>5.00E+4n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens)
BDBM32355
PNG
(MLS000730065 | N-cyclopentyl-2,4-diketo-3-p-anisyl...)
Show SMILES COc1ccc(Cn2c(=O)[nH]c3cc(ccc3c2=O)C(=O)NC2CCCC2)cc1
Show InChI InChI=1S/C22H23N3O4/c1-29-17-9-6-14(7-10-17)13-25-21(27)18-11-8-15(12-19(18)24-22(25)28)20(26)23-16-4-2-3-5-16/h6-12,16H,2-5,13H2,1H3,(H,23,26)(H,24,28)
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n/an/a>5.00E+4n/an/an/an/a7.223



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The PKD HTS assay was developed and run at the University of Pittsburgh Molecular Screening Center (PMLSC) as part of the Molecular Library Screening...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2FJ2F43
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%