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6 similar compounds to monomer 50280291

Wt: 476.5
BDBM50148089
Wt: 476.5
BDBM50148099
Wt: 462.5
BDBM50148103
Wt: 462.5
BDBM50148108
Wt: 444.5
BDBM50280292
Wt: 484.5
BDBM50281874

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 19 hits for monomerid = 50148089,50148099,50148103,50148108,50280292,50281874   
Target
(Institution)
LigandTarget
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
LTB4R


(HUMAN)
BDBM50280292
PNG
(7-[3-(2-Ethyl-5-hydroxy-4-methoxy-phenoxy)-propoxy...)
Show SMILES CCCc1c(OCCCOc2cc(O)c(OC)cc2CC)ccc2CCC(Oc12)C(O)=O
Show InChI InChI=1S/C25H32O7/c1-4-7-18-20(10-8-17-9-11-21(25(27)28)32-24(17)18)30-12-6-13-31-22-15-19(26)23(29-3)14-16(22)5-2/h8,10,14-15,21,26H,4-7,9,11-13H2,1-3H3,(H,27,28)
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1.90n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro binding affinity using [3H]-LTB4 radioligand binding to leukotriene B4 receptor in guinea pig lung membrane binding assay


Bioorg Med Chem Lett 2: 1675-1680 (1992)

More data for this
Ligand-Target Pair
LTB4R


(HUMAN)
BDBM50281874
PNG
(6-[3-(4-Acetyl-3-methoxy-2-propyl-phenoxy)-propoxy...)
Show SMILES CCCc1cc(OCCCOc2ccc(C(C)=O)c(OC)c2CCC)cc2CCC(Oc12)C(O)=O
Show InChI InChI=1S/C28H36O7/c1-5-8-19-16-21(17-20-10-12-25(28(30)31)35-26(19)20)33-14-7-15-34-24-13-11-22(18(3)29)27(32-4)23(24)9-6-2/h11,13,16-17,25H,5-10,12,14-15H2,1-4H3,(H,30,31)
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15n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against LTB4 receptor in guinea pig membrane


Bioorg Med Chem Lett 3: 1147-1152 (1993)

More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50148099
PNG
(7-[4-(4-Phenoxy-2-propyl-phenoxy)-butoxy]-chroman-...)
Show SMILES CCCc1cc(Oc2ccccc2)ccc1OCCCCOc1ccc2CCC(Oc2c1)C(O)=O
Show InChI InChI=1S/C29H32O6/c1-2-8-22-19-25(34-23-9-4-3-5-10-23)14-16-26(22)33-18-7-6-17-32-24-13-11-21-12-15-27(29(30)31)35-28(21)20-24/h3-5,9-11,13-14,16,19-20,27H,2,6-8,12,15,17-18H2,1H3,(H,30,31)
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n/an/a>1.50E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity for human peroxisome proliferator activated receptor alpha using scintillation proximity assay (SPA)


J Med Chem 47: 3255-63 (2004)

More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50148099
PNG
(7-[4-(4-Phenoxy-2-propyl-phenoxy)-butoxy]-chroman-...)
Show SMILES CCCc1cc(Oc2ccccc2)ccc1OCCCCOc1ccc2CCC(Oc2c1)C(O)=O
Show InChI InChI=1S/C29H32O6/c1-2-8-22-19-25(34-23-9-4-3-5-10-23)14-16-26(22)33-18-7-6-17-32-24-13-11-21-12-15-27(29(30)31)35-28(21)20-24/h3-5,9-11,13-14,16,19-20,27H,2,6-8,12,15,17-18H2,1H3,(H,30,31)
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n/an/an/an/a 1.60E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
In vitro potency of PPAR gene activation against human PPAR gamma receptor using chimeric Gal4-hPPAR transactivation assay (TA)


J Med Chem 47: 3255-63 (2004)

More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50148089
PNG
(2-Methyl-7-[3-(4-phenoxy-2-propyl-phenoxy)-propoxy...)
Show SMILES CCCc1cc(Oc2ccccc2)ccc1OCCCOc1ccc2CCC(C)(Oc2c1)C(O)=O
Show InChI InChI=1S/C29H32O6/c1-3-8-22-19-25(34-23-9-5-4-6-10-23)13-14-26(22)33-18-7-17-32-24-12-11-21-15-16-29(2,28(30)31)35-27(21)20-24/h4-6,9-14,19-20H,3,7-8,15-18H2,1-2H3,(H,30,31)
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n/an/an/an/a 1.00E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
In vitro potency of PPAR gene activation against human PPAR gamma receptor using chimeric Gal4-hPPAR transactivation assay (TA)


J Med Chem 47: 3255-63 (2004)

More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50148108
PNG
(7-[3-(4-Phenoxy-2-propyl-phenoxy)-propoxy]-chroman...)
Show SMILES CCCc1cc(Oc2ccccc2)ccc1OCCCOc1ccc2CCC(Oc2c1)C(O)=O
Show InChI InChI=1S/C28H30O6/c1-2-7-21-18-24(33-22-8-4-3-5-9-22)13-15-25(21)32-17-6-16-31-23-12-10-20-11-14-26(28(29)30)34-27(20)19-23/h3-5,8-10,12-13,15,18-19,26H,2,6-7,11,14,16-17H2,1H3,(H,29,30)
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n/an/an/an/a 3.00E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
In vitro potency of PPAR gene activation against human Peroxisome proliferator activated receptor alpha using chimeric Gal4-hPPAR transactivation ass...


J Med Chem 47: 3255-63 (2004)

More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50148089
PNG
(2-Methyl-7-[3-(4-phenoxy-2-propyl-phenoxy)-propoxy...)
Show SMILES CCCc1cc(Oc2ccccc2)ccc1OCCCOc1ccc2CCC(C)(Oc2c1)C(O)=O
Show InChI InChI=1S/C29H32O6/c1-3-8-22-19-25(34-23-9-5-4-6-10-23)13-14-26(22)33-18-7-17-32-24-12-11-21-15-16-29(2,28(30)31)35-27(21)20-24/h4-6,9-14,19-20H,3,7-8,15-18H2,1-2H3,(H,30,31)
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n/an/a 1.90E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity for human peroxisome proliferator activated receptor alpha using scintillation proximity assay (SPA)


J Med Chem 47: 3255-63 (2004)

More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50148108
PNG
(7-[3-(4-Phenoxy-2-propyl-phenoxy)-propoxy]-chroman...)
Show SMILES CCCc1cc(Oc2ccccc2)ccc1OCCCOc1ccc2CCC(Oc2c1)C(O)=O
Show InChI InChI=1S/C28H30O6/c1-2-7-21-18-24(33-22-8-4-3-5-9-22)13-15-25(21)32-17-6-16-31-23-12-10-20-11-14-26(28(29)30)34-27(20)19-23/h3-5,8-10,12-13,15,18-19,26H,2,6-7,11,14,16-17H2,1H3,(H,29,30)
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n/an/an/an/a 7.30E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
In vitro potency of PPAR gene activation against human PPAR gamma receptor using chimeric Gal4-hPPAR transactivation assay (TA)


J Med Chem 47: 3255-63 (2004)

More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50148103
PNG
(6-[3-(4-Phenoxy-2-propyl-phenoxy)-propoxy]-chroman...)
Show SMILES CCCc1cc(Oc2ccccc2)ccc1OCCCOc1ccc2OC(CCc2c1)C(O)=O
Show InChI InChI=1S/C28H30O6/c1-2-7-20-19-24(33-22-8-4-3-5-9-22)12-14-25(20)32-17-6-16-31-23-11-15-26-21(18-23)10-13-27(34-26)28(29)30/h3-5,8-9,11-12,14-15,18-19,27H,2,6-7,10,13,16-17H2,1H3,(H,29,30)
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n/an/a 2.90E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity for human peroxisome proliferator activated receptor gamma using scintillation proximity assay (SPA)


J Med Chem 47: 3255-63 (2004)

More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50148089
PNG
(2-Methyl-7-[3-(4-phenoxy-2-propyl-phenoxy)-propoxy...)
Show SMILES CCCc1cc(Oc2ccccc2)ccc1OCCCOc1ccc2CCC(C)(Oc2c1)C(O)=O
Show InChI InChI=1S/C29H32O6/c1-3-8-22-19-25(34-23-9-5-4-6-10-23)13-14-26(22)33-18-7-17-32-24-12-11-21-15-16-29(2,28(30)31)35-27(21)20-24/h4-6,9-14,19-20H,3,7-8,15-18H2,1-2H3,(H,30,31)
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n/an/an/an/a 100n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
In vitro potency of PPAR gene activation against human Peroxisome proliferator activated receptor alpha using chimeric Gal4-hPPAR transactivation ass...


J Med Chem 47: 3255-63 (2004)

More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50148089
PNG
(2-Methyl-7-[3-(4-phenoxy-2-propyl-phenoxy)-propoxy...)
Show SMILES CCCc1cc(Oc2ccccc2)ccc1OCCCOc1ccc2CCC(C)(Oc2c1)C(O)=O
Show InChI InChI=1S/C29H32O6/c1-3-8-22-19-25(34-23-9-5-4-6-10-23)13-14-26(22)33-18-7-17-32-24-12-11-21-15-16-29(2,28(30)31)35-27(21)20-24/h4-6,9-14,19-20H,3,7-8,15-18H2,1-2H3,(H,30,31)
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n/an/a 750n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity for human peroxisome proliferator activated receptor gamma using scintillation proximity assay (SPA)


J Med Chem 47: 3255-63 (2004)

More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50148099
PNG
(7-[4-(4-Phenoxy-2-propyl-phenoxy)-butoxy]-chroman-...)
Show SMILES CCCc1cc(Oc2ccccc2)ccc1OCCCCOc1ccc2CCC(Oc2c1)C(O)=O
Show InChI InChI=1S/C29H32O6/c1-2-8-22-19-25(34-23-9-4-3-5-10-23)14-16-26(22)33-18-7-6-17-32-24-13-11-21-12-15-27(29(30)31)35-28(21)20-24/h3-5,9-11,13-14,16,19-20,27H,2,6-8,12,15,17-18H2,1H3,(H,30,31)
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n/an/an/an/a 6.30E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
In vitro potency of PPAR gene activation against human Peroxisome proliferator activated receptor alpha using chimeric Gal4-hPPAR transactivation ass...


J Med Chem 47: 3255-63 (2004)

More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50148108
PNG
(7-[3-(4-Phenoxy-2-propyl-phenoxy)-propoxy]-chroman...)
Show SMILES CCCc1cc(Oc2ccccc2)ccc1OCCCOc1ccc2CCC(Oc2c1)C(O)=O
Show InChI InChI=1S/C28H30O6/c1-2-7-21-18-24(33-22-8-4-3-5-9-22)13-15-25(21)32-17-6-16-31-23-12-10-20-11-14-26(28(29)30)34-27(20)19-23/h3-5,8-10,12-13,15,18-19,26H,2,6-7,11,14,16-17H2,1H3,(H,29,30)
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n/an/a 980n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity for human peroxisome proliferator activated receptor gamma using scintillation proximity assay (SPA)


J Med Chem 47: 3255-63 (2004)

More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50148103
PNG
(6-[3-(4-Phenoxy-2-propyl-phenoxy)-propoxy]-chroman...)
Show SMILES CCCc1cc(Oc2ccccc2)ccc1OCCCOc1ccc2OC(CCc2c1)C(O)=O
Show InChI InChI=1S/C28H30O6/c1-2-7-20-19-24(33-22-8-4-3-5-9-22)12-14-25(20)32-17-6-16-31-23-11-15-26-21(18-23)10-13-27(34-26)28(29)30/h3-5,8-9,11-12,14-15,18-19,27H,2,6-7,10,13,16-17H2,1H3,(H,29,30)
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n/an/an/an/a 2.80E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
In vitro potency of PPAR gene activation against human PPAR gamma receptor using chimeric Gal4-hPPAR transactivation assay (TA)


J Med Chem 47: 3255-63 (2004)

More data for this
Ligand-Target Pair
LTB4R


(HUMAN)
BDBM50281874
PNG
(6-[3-(4-Acetyl-3-methoxy-2-propyl-phenoxy)-propoxy...)
Show SMILES CCCc1cc(OCCCOc2ccc(C(C)=O)c(OC)c2CCC)cc2CCC(Oc12)C(O)=O
Show InChI InChI=1S/C28H36O7/c1-5-8-19-16-21(17-20-10-12-25(28(30)31)35-26(19)20)33-14-7-15-34-24-13-11-22(18(3)29)27(32-4)23(24)9-6-2/h11,13,16-17,25H,5-10,12,14-15H2,1-4H3,(H,30,31)
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n/an/a 41.3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition against LTB4 receptor in human neutrophil


Bioorg Med Chem Lett 3: 1147-1152 (1993)

More data for this
Ligand-Target Pair
LTB4R


(HUMAN)
BDBM50280292
PNG
(7-[3-(2-Ethyl-5-hydroxy-4-methoxy-phenoxy)-propoxy...)
Show SMILES CCCc1c(OCCCOc2cc(O)c(OC)cc2CC)ccc2CCC(Oc12)C(O)=O
Show InChI InChI=1S/C25H32O7/c1-4-7-18-20(10-8-17-9-11-21(25(27)28)32-24(17)18)30-12-6-13-31-22-15-19(26)23(29-3)14-16(22)5-2/h8,10,14-15,21,26H,4-7,9,11-13H2,1-3H3,(H,27,28)
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n/an/a 2.90n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro binding affinity using [3H]-LTB4 radioligand binding to leukotriene B4 receptor in human neutrophil binding assay


Bioorg Med Chem Lett 2: 1675-1680 (1992)

More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (human))
BDBM50148099
PNG
(7-[4-(4-Phenoxy-2-propyl-phenoxy)-butoxy]-chroman-...)
Show SMILES CCCc1cc(Oc2ccccc2)ccc1OCCCCOc1ccc2CCC(Oc2c1)C(O)=O
Show InChI InChI=1S/C29H32O6/c1-2-8-22-19-25(34-23-9-4-3-5-10-23)14-16-26(22)33-18-7-6-17-32-24-13-11-21-12-15-27(29(30)31)35-28(21)20-24/h3-5,9-11,13-14,16,19-20,27H,2,6-8,12,15,17-18H2,1H3,(H,30,31)
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n/an/a 1.80E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity for human peroxisome proliferator activated receptor gamma using scintillation proximity assay (SPA)


J Med Chem 47: 3255-63 (2004)

More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50148103
PNG
(6-[3-(4-Phenoxy-2-propyl-phenoxy)-propoxy]-chroman...)
Show SMILES CCCc1cc(Oc2ccccc2)ccc1OCCCOc1ccc2OC(CCc2c1)C(O)=O
Show InChI InChI=1S/C28H30O6/c1-2-7-20-19-24(33-22-8-4-3-5-9-22)12-14-25(20)32-17-6-16-31-23-11-15-26-21(18-23)10-13-27(34-26)28(29)30/h3-5,8-9,11-12,14-15,18-19,27H,2,6-7,10,13,16-17H2,1H3,(H,29,30)
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n/an/a>1.50E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity for human peroxisome proliferator activated receptor alpha using scintillation proximity assay (SPA)


J Med Chem 47: 3255-63 (2004)

More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM50148108
PNG
(7-[3-(4-Phenoxy-2-propyl-phenoxy)-propoxy]-chroman...)
Show SMILES CCCc1cc(Oc2ccccc2)ccc1OCCCOc1ccc2CCC(Oc2c1)C(O)=O
Show InChI InChI=1S/C28H30O6/c1-2-7-21-18-24(33-22-8-4-3-5-9-22)13-15-25(21)32-17-6-16-31-23-12-10-20-11-14-26(28(29)30)34-27(20)19-23/h3-5,8-10,12-13,15,18-19,26H,2,6-7,11,14,16-17H2,1H3,(H,29,30)
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Article
PubMed
n/an/a 1.50E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity for human peroxisome proliferator activated receptor alpha using scintillation proximity assay (SPA)


J Med Chem 47: 3255-63 (2004)

More data for this
Ligand-Target Pair