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SMILES: OC(=O)[C@H](Cc1ccc(OCCOc2ccc(Br)cc2)cc1)Nc1ccccc1C(=O)c1ccccc1

InChI Key: InChIKey=HRFLBDUMTMBRKG-NDEPHWFRSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50471984   
Target/Host
(Institution)
LigandTarget/Host
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
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50471984
PNG
(CHEMBL149677)
Show SMILES OC(=O)[C@H](Cc1ccc(OCCOc2ccc(Br)cc2)cc1)Nc1ccccc1C(=O)c1ccccc1
Show InChI InChI=1S/C30H26BrNO5/c31-23-12-16-25(17-13-23)37-19-18-36-24-14-10-21(11-15-24)20-28(30(34)35)32-27-9-5-4-8-26(27)29(33)22-6-2-1-3-7-22/h1-17,28,32H,18-20H2,(H,34,35)/t28-/m0/s1
PDB
MMDB

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19n/an/an/an/an/an/an/an/a



Glaxo Wellcome Research and Development

Curated by ChEMBL


Assay Description
Inhibition by 50% of in vitro binding to Peroxisome proliferator activated receptor gamma


J Med Chem 41: 5037-54 (1998)


Article DOI: 10.1021/jm980413z
BindingDB Entry DOI: 10.7270/Q2J38W9F
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50471984
PNG
(CHEMBL149677)
Show SMILES OC(=O)[C@H](Cc1ccc(OCCOc2ccc(Br)cc2)cc1)Nc1ccccc1C(=O)c1ccccc1
Show InChI InChI=1S/C30H26BrNO5/c31-23-12-16-25(17-13-23)37-19-18-36-24-14-10-21(11-15-24)20-28(30(34)35)32-27-9-5-4-8-26(27)29(33)22-6-2-1-3-7-22/h1-17,28,32H,18-20H2,(H,34,35)/t28-/m0/s1
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72n/an/an/an/an/an/an/an/a



Glaxo Wellcome Research and Development

Curated by ChEMBL


Assay Description
Inhibition by 50% of in vitro binding to Peroxisome proliferator activated receptor gamma


J Med Chem 41: 5037-54 (1998)


Article DOI: 10.1021/jm980413z
BindingDB Entry DOI: 10.7270/Q2J38W9F
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50471984
PNG
(CHEMBL149677)
Show SMILES OC(=O)[C@H](Cc1ccc(OCCOc2ccc(Br)cc2)cc1)Nc1ccccc1C(=O)c1ccccc1
Show InChI InChI=1S/C30H26BrNO5/c31-23-12-16-25(17-13-23)37-19-18-36-24-14-10-21(11-15-24)20-28(30(34)35)32-27-9-5-4-8-26(27)29(33)22-6-2-1-3-7-22/h1-17,28,32H,18-20H2,(H,34,35)/t28-/m0/s1
PDB
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n/an/an/an/a 269n/an/an/an/a



Glaxo Wellcome Research and Development

Curated by ChEMBL


Assay Description
Tested functionally in vitro for inducing 50% of the maximum alkaline phosphate activity (Transactivation) against Peroxisome proliferator activated ...


J Med Chem 41: 5037-54 (1998)


Article DOI: 10.1021/jm980413z
BindingDB Entry DOI: 10.7270/Q2J38W9F
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50471984
PNG
(CHEMBL149677)
Show SMILES OC(=O)[C@H](Cc1ccc(OCCOc2ccc(Br)cc2)cc1)Nc1ccccc1C(=O)c1ccccc1
Show InChI InChI=1S/C30H26BrNO5/c31-23-12-16-25(17-13-23)37-19-18-36-24-14-10-21(11-15-24)20-28(30(34)35)32-27-9-5-4-8-26(27)29(33)22-6-2-1-3-7-22/h1-17,28,32H,18-20H2,(H,34,35)/t28-/m0/s1
PDB
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n/an/an/an/a 457n/an/an/an/a



Glaxo Wellcome Research and Development

Curated by ChEMBL


Assay Description
Ability to promote differentiation of C3H10T1/2 stem cells to adipocytes using lipogenesis assay mediated through activation of Peroxisome proliferat...


J Med Chem 41: 5037-54 (1998)


Article DOI: 10.1021/jm980413z
BindingDB Entry DOI: 10.7270/Q2J38W9F
More data for this
Ligand-Target Pair