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Compile Data Set for Download or QSAR

Found 6 hits Enz. Inhib. hit(s) with all data for assayid = 1 entry = 50022932   
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
1-phosphatidylinositol 4,5-bisphosphate phosphodiesterase gamma-1


(Bos taurus)
BDBM50242263
PNG
((Z)-3-(pentadec-8-enyl)phenol | 3-[8'(Z)-pentadece...)
Show SMILES CCCCCC\C=C/CCCCCCCc1cccc(O)c1
Show InChI InChI=1S/C21H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-20-17-15-18-21(22)19-20/h7-8,15,17-19,22H,2-6,9-14,16H2,1H3/b8-7-
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PubMed
n/an/a 3.51E+3n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain PI-PLCgamma1 at 125 ug/mL


J Nat Prod 61: 867-71 (1998)


Article DOI: 10.1021/np970367q
BindingDB Entry DOI: 10.7270/Q25Q4VVG
More data for this
Ligand-Target Pair
1-phosphatidylinositol 4,5-bisphosphate phosphodiesterase gamma-1


(Bos taurus)
BDBM50259930
PNG
(6-(10'Z-heptadecenyl)-salicylicacid | 6-[10'(Z)-he...)
Show SMILES CCCCCC\C=C/CCCCCCCCCc1cccc(O)c1C(O)=O
Show InChI InChI=1S/C24H38O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21-19-17-20-22(25)23(21)24(26)27/h7-8,17,19-20,25H,2-6,9-16,18H2,1H3,(H,26,27)/b8-7-
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n/an/a 7.40E+4n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain PI-PLCgamma1 at 125 ug/mL


J Nat Prod 61: 867-71 (1998)


Article DOI: 10.1021/np970367q
BindingDB Entry DOI: 10.7270/Q25Q4VVG
More data for this
Ligand-Target Pair
1-phosphatidylinositol 4,5-bisphosphate phosphodiesterase gamma-1


(Bos taurus)
BDBM50242188
PNG
(6-(8'Z-pentadecenyl)-salicylicacid | 6-[8'(Z)-pent...)
Show SMILES CCCCCC\C=C/CCCCCCCc1cccc(O)c1C(O)=O
Show InChI InChI=1S/C22H34O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19-17-15-18-20(23)21(19)22(24)25/h7-8,15,17-18,23H,2-6,9-14,16H2,1H3,(H,24,25)/b8-7-
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n/an/a 7.63E+4n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain PI-PLCgamma1 at 125 ug/mL


J Nat Prod 61: 867-71 (1998)


Article DOI: 10.1021/np970367q
BindingDB Entry DOI: 10.7270/Q25Q4VVG
More data for this
Ligand-Target Pair
1-phosphatidylinositol 4,5-bisphosphate phosphodiesterase gamma-1


(Bos taurus)
BDBM50259929
PNG
(3-tridecyl phenol | CHEMBL448270)
Show SMILES CCCCCCCCCCCCCc1cccc(O)c1
Show InChI InChI=1S/C19H32O/c1-2-3-4-5-6-7-8-9-10-11-12-14-18-15-13-16-19(20)17-18/h13,15-17,20H,2-12,14H2,1H3
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n/an/a 8.80E+4n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain PI-PLCgamma1 at 125 ug/mL


J Nat Prod 61: 867-71 (1998)


Article DOI: 10.1021/np970367q
BindingDB Entry DOI: 10.7270/Q25Q4VVG
More data for this
Ligand-Target Pair
1-phosphatidylinositol 4,5-bisphosphate phosphodiesterase gamma-1


(Bos taurus)
BDBM50082305
PNG
(3-Pentadecyl-phenol | 3-pentadecyl phenol | 3-pent...)
Show SMILES CCCCCCCCCCCCCCCc1cccc(O)c1
Show InChI InChI=1S/C21H36O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-20-17-15-18-21(22)19-20/h15,17-19,22H,2-14,16H2,1H3
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n/an/a 9.26E+4n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain PI-PLCgamma1 at 125 ug/mL


J Nat Prod 61: 867-71 (1998)


Article DOI: 10.1021/np970367q
BindingDB Entry DOI: 10.7270/Q25Q4VVG
More data for this
Ligand-Target Pair
1-phosphatidylinositol 4,5-bisphosphate phosphodiesterase gamma-1


(Bos taurus)
BDBM50259927
PNG
(3-[10'(Z)-heptadecenyl]phenol | CHEMBL470127)
Show SMILES CCCCCC\C=C/CCCCCCCCCc1cccc(O)c1
Show InChI InChI=1S/C23H38O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-22-19-17-20-23(24)21-22/h7-8,17,19-21,24H,2-6,9-16,18H2,1H3/b8-7-
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Article
PubMed
n/an/a 9.50E+4n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Inhibition of bovine brain PI-PLCgamma1 at 125 ug/mL


J Nat Prod 61: 867-71 (1998)


Article DOI: 10.1021/np970367q
BindingDB Entry DOI: 10.7270/Q25Q4VVG
More data for this
Ligand-Target Pair