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Compile Data Set for Download or QSAR

Found 5 hits with Last Name = 'kamada' and Initial = 'r'   
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
Protein phosphatase 1D


(Homo sapiens (Human))
BDBM50118477
PNG
(CHEMBL3613748)
Show SMILES [H][C@]12C[C@@H](C[C@@](C)(C(O)=O)[C@]1([H])CCC[C@H]2O[Si](CC)(CC)CC)O[Si](C)(C)C(C)(C)C |r|
Show InChI InChI=1S/C24H48O4Si2/c1-10-30(11-2,12-3)28-21-15-13-14-20-19(21)16-18(17-24(20,7)22(25)26)27-29(8,9)23(4,5)6/h18-21H,10-17H2,1-9H3,(H,25,26)/t18-,19-,20+,21+,24+/m0/s1
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228n/an/an/an/an/an/an/an/a



Hokkaido University

Curated by ChEMBL


Assay Description
Non-competitive inhibition of His-tagged PPM1D (1 to 420 residues) (unknown origin) expressed in Escherichia coli BL21 (DE3) pLysS cells using Ac-VEP...


Bioorg Med Chem 23: 6246-9 (2015)


Article DOI: 10.1016/j.bmc.2015.08.042
BindingDB Entry DOI: 10.7270/Q26975C7
More data for this
Ligand-Target Pair
Protein phosphatase 1D


(Homo sapiens (Human))
BDBM50118478
PNG
(CHEMBL3613749)
Show SMILES Cc1ncc(Cl)cc1NCc1ccc(s1)C(=O)N[C@@H](CC1CCCC1)C(=O)NC1CC1 |r|
Show InChI InChI=1S/C23H29ClN4O2S/c1-14-19(11-16(24)12-25-14)26-13-18-8-9-21(31-18)23(30)28-20(10-15-4-2-3-5-15)22(29)27-17-6-7-17/h8-9,11-12,15,17,20,26H,2-7,10,13H2,1H3,(H,27,29)(H,28,30)/t20-/m0/s1
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MCE
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Article
PubMed
n/an/a 86n/an/an/an/an/an/a



Hokkaido University

Curated by ChEMBL


Assay Description
Inhibition of His-tagged PPM1D (1 to 420 residues) (unknown origin) expressed in Escherichia coli BL21 (DE3) pLysS cells using Ac-VEPPLS(P)QETFSDLW-N...


Bioorg Med Chem 23: 6246-9 (2015)


Article DOI: 10.1016/j.bmc.2015.08.042
BindingDB Entry DOI: 10.7270/Q26975C7
More data for this
Ligand-Target Pair
Protein phosphatase 1D


(Homo sapiens (Human))
BDBM50361941
PNG
(CHEMBL1939361)
Show SMILES CC[Si](CC)(CC)O[C@@H]1C[C@H](C)C[C@@H]2[C@@H]1C[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]1[C@](C)(CO)C[C@H](O)C[C@@]21C |r|
Show InChI InChI=1S/C30H60O4Si2/c1-12-36(13-2,14-3)34-25-16-21(4)15-24-23(25)17-26(33-35(10,11)28(5,6)7)27-29(8,20-31)18-22(32)19-30(24,27)9/h21-27,31-32H,12-20H2,1-11H3/t21-,22+,23+,24-,25-,26+,27-,29+,30+/m1/s1
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n/an/a 87n/an/an/an/an/an/a



Hokkaido University

Curated by ChEMBL


Assay Description
Inhibition of His-tagged PPM1D (1 to 420 residues) (unknown origin) expressed in Escherichia coli BL21 (DE3) pLysS cells using Ac-VEPPLS(P)QETFSDLW-N...


Bioorg Med Chem 23: 6246-9 (2015)


Article DOI: 10.1016/j.bmc.2015.08.042
BindingDB Entry DOI: 10.7270/Q26975C7
More data for this
Ligand-Target Pair
Protein phosphatase 1D


(Homo sapiens (Human))
BDBM50118477
PNG
(CHEMBL3613748)
Show SMILES [H][C@]12C[C@@H](C[C@@](C)(C(O)=O)[C@]1([H])CCC[C@H]2O[Si](CC)(CC)CC)O[Si](C)(C)C(C)(C)C |r|
Show InChI InChI=1S/C24H48O4Si2/c1-10-30(11-2,12-3)28-21-15-13-14-20-19(21)16-18(17-24(20,7)22(25)26)27-29(8,9)23(4,5)6/h18-21H,10-17H2,1-9H3,(H,25,26)/t18-,19-,20+,21+,24+/m0/s1
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PubMed
n/an/a 110n/an/an/an/an/an/a



Hokkaido University

Curated by ChEMBL


Assay Description
Inhibition of His-tagged PPM1D (1 to 420 residues) (unknown origin) expressed in Escherichia coli BL21 (DE3) pLysS cells using Ac-VEPPLS(P)QETFSDLW-N...


Bioorg Med Chem 23: 6246-9 (2015)


Article DOI: 10.1016/j.bmc.2015.08.042
BindingDB Entry DOI: 10.7270/Q26975C7
More data for this
Ligand-Target Pair
Protein phosphatase 1D


(Homo sapiens (Human))
BDBM50118476
PNG
(CHEMBL3613747)
Show SMILES [H][C@]12C[C@@H](C[C@@](C)(CO)[C@]1([H])CCC[C@H]2O[Si](CC)(CC)CC)O[Si](C)(C)C(C)(C)C |r|
Show InChI InChI=1S/C24H50O3Si2/c1-10-29(11-2,12-3)27-22-15-13-14-21-20(22)16-19(17-24(21,7)18-25)26-28(8,9)23(4,5)6/h19-22,25H,10-18H2,1-9H3/t19-,20-,21+,22+,24-/m0/s1
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CHEMBL
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Article
PubMed
n/an/a 215n/an/an/an/an/an/a



Hokkaido University

Curated by ChEMBL


Assay Description
Inhibition of His-tagged PPM1D (1 to 420 residues) (unknown origin) expressed in Escherichia coli BL21 (DE3) pLysS cells using Ac-VEPPLS(P)QETFSDLW-N...


Bioorg Med Chem 23: 6246-9 (2015)


Article DOI: 10.1016/j.bmc.2015.08.042
BindingDB Entry DOI: 10.7270/Q26975C7
More data for this
Ligand-Target Pair