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PubMed code 9651167

Compile data set for download or QSAR
Found 20 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
Platelet-activating factor receptor


(Cavia porcellus)		BDBM50065348
PNG
((1S,4aR,5S)-1,4a-Dimethyl-6-methylene-5-[2-(2-oxo-...)
Show SMILES COC(=O)[C@@]1(C)CCC[C@]2(C)[C@@H](CCC3=CCOC3=O)C(=C)CCC12 |t:14|
Show InChI InChI=1S/C21H30O4/c1-14-6-9-17-20(2,11-5-12-21(17,3)19(23)24-4)16(14)8-7-15-10-13-25-18(15)22/h10,16-17H,1,5-9,11-13H2,2-4H3/t16-,17?,20+,21-/m0/s1
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n/an/a 250n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against PAF receptor using [3H]-PAF as radioligand in rabbit platelets

J Med Chem 41: 2626-30 (1998)


Article DOI: 10.1021/jm970569j
BindingDB Entry DOI: 10.7270/Q2BG2N4Z
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Cavia porcellus)		BDBM50065336
PNG
((1S,4aS,5R)-1,4a-Dimethyl-6-oxo-5-[2-(2-oxo-2,5-di...)
Show SMILES COC(=O)[C@@]1(C)CCC[C@]2(C)[C@@H](CCC3=CCOC3=O)C(=O)CCC12 |t:14|
Show InChI InChI=1S/C20H28O5/c1-19-10-4-11-20(2,18(23)24-3)16(19)8-7-15(21)14(19)6-5-13-9-12-25-17(13)22/h9,14,16H,4-8,10-12H2,1-3H3/t14-,16?,19+,20-/m0/s1
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n/an/a 260n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against PAF receptor using [3H]-PAF as radioligand in rabbit platelets

J Med Chem 41: 2626-30 (1998)


Article DOI: 10.1021/jm970569j
BindingDB Entry DOI: 10.7270/Q2BG2N4Z
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Cavia porcellus)		BDBM50065344
PNG
(CHEMBL89088 | methyl 5,8a-dimethyl-1-[2-(2-oxo-2,5...)
Show SMILES COC(=O)[C@@]1(C)CCC[C@]2(C)[C@@H](CCC3=CCOC3=O)[C@@]3(CO3)CCC12 |t:14|
Show InChI InChI=1S/C21H30O5/c1-19-9-4-10-20(2,18(23)24-3)15(19)7-11-21(13-26-21)16(19)6-5-14-8-12-25-17(14)22/h8,15-16H,4-7,9-13H2,1-3H3/t15?,16-,19+,20+,21+/m1/s1
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n/an/a 1.00E+3n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against PAF receptor using [3H]-PAF as radioligand in rabbit platelets

J Med Chem 41: 2626-30 (1998)


Article DOI: 10.1021/jm970569j
BindingDB Entry DOI: 10.7270/Q2BG2N4Z
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Cavia porcellus)		BDBM50065343
PNG
((1S,4aR,5S,6S)-6-Hydroxymethyl-1,4a-dimethyl-5-[2-...)
Show SMILES COC(=O)[C@@]1(C)CCC[C@]2(C)[C@@H](CCC3=CCOC3=O)[C@@H](CO)CCC12 |t:14|
Show InChI InChI=1S/C21H32O5/c1-20-10-4-11-21(2,19(24)25-3)17(20)8-6-15(13-22)16(20)7-5-14-9-12-26-18(14)23/h9,15-17,22H,4-8,10-13H2,1-3H3/t15-,16+,17?,20-,21+/m1/s1
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n/an/a 1.60E+3n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against PAF receptor using [3H]-PAF as radioligand in rabbit platelets

J Med Chem 41: 2626-30 (1998)


Article DOI: 10.1021/jm970569j
BindingDB Entry DOI: 10.7270/Q2BG2N4Z
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Cavia porcellus)		BDBM50065339
PNG
((1S,4aS)-6-Formyl-1,4a-dimethyl-5-[2-(2-oxo-2,5-di...)
Show SMILES COC(=O)[C@@]1(C)CCC[C@@]2(C)C1CCC(C=O)=C2CCC1=CCOC1=O |c:17,t:22|
Show InChI InChI=1S/C21H28O5/c1-20-10-4-11-21(2,19(24)25-3)17(20)8-6-15(13-22)16(20)7-5-14-9-12-26-18(14)23/h9,13,17H,4-8,10-12H2,1-3H3/t17?,20-,21+/m1/s1
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n/an/a 1.70E+3n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against PAF receptor using [3H]-PAF as radioligand in rabbit platelets

J Med Chem 41: 2626-30 (1998)


Article DOI: 10.1021/jm970569j
BindingDB Entry DOI: 10.7270/Q2BG2N4Z
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Cavia porcellus)		BDBM50065347
PNG
(3-[2-((1S,5S,8aR)-5-Methoxymethyl-5,8a-dimethyl-2-...)
Show SMILES COC[C@@]1(C)CCC[C@]2(C)[C@@H](CCC3=CCOC3=O)C(=C)CCC12 |t:13|
Show InChI InChI=1S/C21H32O3/c1-15-6-9-18-20(2,14-23-4)11-5-12-21(18,3)17(15)8-7-16-10-13-24-19(16)22/h10,17-18H,1,5-9,11-14H2,2-4H3/t17-,18?,20+,21+/m0/s1
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n/an/a 1.70E+3n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against PAF receptor using [3H]-PAF as radioligand in rabbit platelets

J Med Chem 41: 2626-30 (1998)


Article DOI: 10.1021/jm970569j
BindingDB Entry DOI: 10.7270/Q2BG2N4Z
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Cavia porcellus)		BDBM50065352
PNG
((1S,4aR,5S)-1,4a-Dimethyl-6-methylene-5-[2-(2-oxo-...)
Show SMILES COC(=O)[C@@]1(C)CCC[C@]2(C)[C@@H](CCC3CCOC3=O)C(=C)CCC12
Show InChI InChI=1S/C21H32O4/c1-14-6-9-17-20(2,11-5-12-21(17,3)19(23)24-4)16(14)8-7-15-10-13-25-18(15)22/h15-17H,1,5-13H2,2-4H3/t15?,16-,17?,20+,21-/m0/s1
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n/an/a 2.00E+3n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against PAF receptor using [3H]-PAF as radioligand in rabbit platelets

J Med Chem 41: 2626-30 (1998)


Article DOI: 10.1021/jm970569j
BindingDB Entry DOI: 10.7270/Q2BG2N4Z
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Cavia porcellus)		BDBM50065335
PNG
((1S,4aS,5R,6S)-6-Hydroxy-1,4a-dimethyl-5-[2-(2-oxo...)
Show SMILES COC(=O)[C@@]1(C)CCC[C@]2(C)[C@@H](CCC3=CCOC3=O)[C@@H](O)CCC12 |t:14|
Show InChI InChI=1S/C20H30O5/c1-19-10-4-11-20(2,18(23)24-3)16(19)8-7-15(21)14(19)6-5-13-9-12-25-17(13)22/h9,14-16,21H,4-8,10-12H2,1-3H3/t14-,15-,16?,19+,20-/m0/s1
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n/an/a 2.00E+3n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against PAF receptor using [3H]-PAF as radioligand in rabbit platelets

J Med Chem 41: 2626-30 (1998)


Article DOI: 10.1021/jm970569j
BindingDB Entry DOI: 10.7270/Q2BG2N4Z
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Cavia porcellus)		BDBM50065342
PNG
((1S,4aS,5R)-1,4a-Dimethyl-6-oxo-5-[2-(2-oxo-tetrah...)
Show SMILES COC(=O)[C@@]1(C)CCC[C@]2(C)[C@@H](CCC3CCOC3=O)C(=O)CCC12
Show InChI InChI=1S/C20H30O5/c1-19-10-4-11-20(2,18(23)24-3)16(19)8-7-15(21)14(19)6-5-13-9-12-25-17(13)22/h13-14,16H,4-12H2,1-3H3/t13?,14-,16?,19+,20-/m0/s1
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n/an/a 2.60E+3n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against PAF receptor using [3H]-PAF as radioligand in rabbit platelets

J Med Chem 41: 2626-30 (1998)


Article DOI: 10.1021/jm970569j
BindingDB Entry DOI: 10.7270/Q2BG2N4Z
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Cavia porcellus)		BDBM50065333
PNG
(6-Hydroxymethyl-1,4a-dimethyl-5-[2-(2-oxo-2,5-dihy...)
Show SMILES COC(=O)[C@@]1(C)CCC[C@@]2(C)C1CCC(CO)=C2CCC1=CCOC1=O |c:17,t:22|
Show InChI InChI=1S/C21H30O5/c1-20-10-4-11-21(2,19(24)25-3)17(20)8-6-15(13-22)16(20)7-5-14-9-12-26-18(14)23/h9,17,22H,4-8,10-13H2,1-3H3/t17?,20-,21+/m1/s1
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n/an/a 4.00E+3n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against PAF receptor using [3H]-PAF as radioligand in rabbit platelets

J Med Chem 41: 2626-30 (1998)


Article DOI: 10.1021/jm970569j
BindingDB Entry DOI: 10.7270/Q2BG2N4Z
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Cavia porcellus)		BDBM50065345
PNG
((1S,4aR,5S)-1,4a,6-Trimethyl-5-[2-(2-oxo-tetrahydr...)
Show SMILES COC(=O)[C@@]1(C)CCC[C@]2(C)[C@@H](CCC3CCOC3=O)C(C)CCC12
Show InChI InChI=1S/C21H34O4/c1-14-6-9-17-20(2,11-5-12-21(17,3)19(23)24-4)16(14)8-7-15-10-13-25-18(15)22/h14-17H,5-13H2,1-4H3/t14?,15?,16-,17?,20+,21-/m0/s1
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n/an/a 4.80E+3n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against PAF receptor using [3H]-PAF as radioligand in rabbit platelets

J Med Chem 41: 2626-30 (1998)


Article DOI: 10.1021/jm970569j
BindingDB Entry DOI: 10.7270/Q2BG2N4Z
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Cavia porcellus)		BDBM50065346
PNG
((1S,4aR,5S)-1,4a-Dimethyl-6-methylene-5-[2-(5-oxo-...)
Show SMILES COC(=O)[C@@]1(C)CCC[C@]2(C)[C@@H](CCC3=CC(=O)OC3)C(=C)CCC12 |t:14|
Show InChI InChI=1S/C21H30O4/c1-14-6-9-17-20(2,10-5-11-21(17,3)19(23)24-4)16(14)8-7-15-12-18(22)25-13-15/h12,16-17H,1,5-11,13H2,2-4H3/t16-,17?,20+,21-/m0/s1
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n/an/a 6.00E+3n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against PAF receptor using [3H]-PAF as radioligand in rabbit platelets

J Med Chem 41: 2626-30 (1998)


Article DOI: 10.1021/jm970569j
BindingDB Entry DOI: 10.7270/Q2BG2N4Z
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Cavia porcellus)		BDBM50065341
PNG
((1R,6S,9aS)-6,9a-Dimethyl-3-oxo-1-[2-(5-oxo-2,5-di...)
Show SMILES COC(=O)[C@@]1(C)CCC[C@@]2(C)C1CCC(=O)O[C@@H]2CCC1=CC(=O)OC1 |t:22|
Show InChI InChI=1S/C20H28O6/c1-19-9-4-10-20(2,18(23)24-3)14(19)6-8-16(21)26-15(19)7-5-13-11-17(22)25-12-13/h11,14-15H,4-10,12H2,1-3H3/t14?,15-,19+,20+/m1/s1
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n/an/a 8.00E+3n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against PAF receptor using [3H]-PAF as radioligand in rabbit platelets

J Med Chem 41: 2626-30 (1998)


Article DOI: 10.1021/jm970569j
BindingDB Entry DOI: 10.7270/Q2BG2N4Z
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Cavia porcellus)		BDBM50065337
PNG
((1S,4aR,5S)-5-((Z)-5-Hydroxy-3-hydroxymethyl-pent-...)
Show SMILES COC(=O)[C@@]1(C)CCC[C@]2(C)[C@@H](CC\C(CO)=C\CO)C(=C)CCC12
Show InChI InChI=1S/C21H34O4/c1-15-6-9-18-20(2,11-5-12-21(18,3)19(24)25-4)17(15)8-7-16(14-23)10-13-22/h10,17-18,22-23H,1,5-9,11-14H2,2-4H3/b16-10-/t17-,18?,20+,21-/m0/s1
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n/an/a 1.20E+4n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against PAF receptor using [3H]-PAF as radioligand in rabbit platelets

J Med Chem 41: 2626-30 (1998)


Article DOI: 10.1021/jm970569j
BindingDB Entry DOI: 10.7270/Q2BG2N4Z
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Cavia porcellus)		BDBM50065351
PNG
((Z)-2-[2-((1S,5S,8aR)-5-Hydroxymethyl-5,8a-dimethy...)
Show SMILES C[C@]1(CO)CCC[C@]2(C)[C@@H](CC\C(CO)=C\CO)C(=C)CCC12
Show InChI InChI=1S/C20H34O3/c1-15-5-8-18-19(2,14-23)10-4-11-20(18,3)17(15)7-6-16(13-22)9-12-21/h9,17-18,21-23H,1,4-8,10-14H2,2-3H3/b16-9-/t17-,18?,19+,20+/m0/s1
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n/an/a 2.10E+4n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against PAF receptor using [3H]-PAF as radioligand in rabbit platelets

J Med Chem 41: 2626-30 (1998)


Article DOI: 10.1021/jm970569j
BindingDB Entry DOI: 10.7270/Q2BG2N4Z
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Cavia porcellus)		BDBM50065350
PNG
((1S,4aR,5S)-1,4a-Dimethyl-6-methylene-5-[2-(2-oxo-...)
Show SMILES C[C@]12CCC[C@@](C)(C1CCC(=C)[C@@H]2CCC1=CCOC1=O)C(O)=O |t:17|
Show InChI InChI=1S/C20H28O4/c1-13-5-8-16-19(2,10-4-11-20(16,3)18(22)23)15(13)7-6-14-9-12-24-17(14)21/h9,15-16H,1,4-8,10-12H2,2-3H3,(H,22,23)/t15-,16?,19+,20-/m0/s1
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n/an/a 2.30E+4n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against PAF receptor using [3H]-PAF as radioligand in rabbit platelets

J Med Chem 41: 2626-30 (1998)


Article DOI: 10.1021/jm970569j
BindingDB Entry DOI: 10.7270/Q2BG2N4Z
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Cavia porcellus)		BDBM50065338
PNG
(3-[2-((1S,5S,8aR)-5-Hydroxymethyl-5,8a-dimethyl-2-...)
Show SMILES C[C@]1(CO)CCC[C@]2(C)[C@@H](CCC3=CCOC3=O)C(=C)CCC12 |t:12|
Show InChI InChI=1S/C20H30O3/c1-14-5-8-17-19(2,13-21)10-4-11-20(17,3)16(14)7-6-15-9-12-23-18(15)22/h9,16-17,21H,1,4-8,10-13H2,2-3H3/t16-,17?,19+,20+/m0/s1
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n/an/a 3.00E+4n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against PAF receptor using [3H]-PAF as radioligand in rabbit platelets

J Med Chem 41: 2626-30 (1998)


Article DOI: 10.1021/jm970569j
BindingDB Entry DOI: 10.7270/Q2BG2N4Z
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Cavia porcellus)		BDBM50065349
PNG
(4-[2-((1S,5S,8aR)-5-Hydroxymethyl-5,8a-dimethyl-2-...)
Show SMILES C[C@]1(CO)CCC[C@]2(C)[C@@H](CCC3=CC(=O)OC3)C(=C)CCC12 |t:12|
Show InChI InChI=1S/C20H30O3/c1-14-5-8-17-19(2,13-21)9-4-10-20(17,3)16(14)7-6-15-11-18(22)23-12-15/h11,16-17,21H,1,4-10,12-13H2,2-3H3/t16-,17?,19+,20+/m0/s1
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n/an/a 1.10E+5n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against PAF receptor using [3H]-PAF as radioligand in rabbit platelets

J Med Chem 41: 2626-30 (1998)


Article DOI: 10.1021/jm970569j
BindingDB Entry DOI: 10.7270/Q2BG2N4Z
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Cavia porcellus)		BDBM50065340
PNG
((1S,4aR,5S)-5-(2-Furan-3-yl-ethyl)-1,4a-dimethyl-6...)
Show SMILES COC(=O)[C@@]1(C)CCC[C@]2(C)[C@@H](CCc3ccoc3)C(=C)CCC12
Show InChI InChI=1S/C21H30O3/c1-15-6-9-18-20(2,11-5-12-21(18,3)19(22)23-4)17(15)8-7-16-10-13-24-14-16/h10,13-14,17-18H,1,5-9,11-12H2,2-4H3/t17-,18?,20+,21-/m0/s1
MMDB

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PubMed
n/an/a>1.00E+6n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against PAF receptor using [3H]-PAF as radioligand in rabbit platelets

J Med Chem 41: 2626-30 (1998)


Article DOI: 10.1021/jm970569j
BindingDB Entry DOI: 10.7270/Q2BG2N4Z
More data for this
Ligand-Target Pair
Platelet-activating factor receptor


(Cavia porcellus)		BDBM50065334
PNG
((1S,4aS,5R,6R)-6-Hydroxy-6-hydroxymethyl-1,4a-dime...)
Show SMILES COC(=O)[C@@]1(C)CCC[C@]2(C)[C@@H](CCC3=CCOC3=O)[C@@](O)(CO)CCC12 |t:14|
Show InChI InChI=1S/C21H32O6/c1-19-9-4-10-20(2,18(24)26-3)15(19)7-11-21(25,13-22)16(19)6-5-14-8-12-27-17(14)23/h8,15-16,22,25H,4-7,9-13H2,1-3H3/t15?,16-,19+,20+,21+/m1/s1
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n/an/a>1.00E+6n/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against PAF receptor using [3H]-PAF as radioligand in rabbit platelets

J Med Chem 41: 2626-30 (1998)


Article DOI: 10.1021/jm970569j
BindingDB Entry DOI: 10.7270/Q2BG2N4Z
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%