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6 similar compounds to monomer 50128299

Wt: 421.5
BDBM50128297
Wt: 379.4
BDBM50128300
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Wt: 351.4
BDBM50128301
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Wt: 393.5
BDBM50128302
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Wt: 365.4
BDBM50128313
Wt: 393.5
BDBM50128315

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 12 hits for monomerid = 50128297,50128300,50128301,50128302,50128313,50128315   
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
Ecdysone receptor


(Choristoneura fumiferana)
BDBM50128297
PNG
(5-Ethyl-2,3-dihydro-benzo[1,4]dioxine-6-carboxylic...)
Show SMILES CCc1c2OCCOc2ccc1C(=O)NC1(CCCCC1)C(=O)c1cc(C)cc(C)c1
Show InChI InChI=1S/C26H31NO4/c1-4-20-21(8-9-22-23(20)31-13-12-30-22)25(29)27-26(10-6-5-7-11-26)24(28)19-15-17(2)14-18(3)16-19/h8-9,14-16H,4-7,10-13H2,1-3H3,(H,27,29)
PDB
MMDB

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n/an/an/an/a 390n/an/an/an/a



RHeoGene

Curated by ChEMBL


Assay Description
Dose affording 50% of maximum transactivation for ecdysone receptor from Choristoneura fumiferana (CfEcR) and a luciferase reporter gene in CHO cells


Bioorg Med Chem Lett 13: 1883-6 (2003)

More data for this
Ligand-Target Pair
Ecdysone receptor


(Bombyx mori)
BDBM50128300
PNG
(CHEMBL55869 | N-[1-(3,5-Dimethyl-benzoyl)-cyclohex...)
Show SMILES COc1cccc(C(=O)NC2(CCCCC2)C(=O)c2cc(C)cc(C)c2)c1C
Show InChI InChI=1S/C24H29NO3/c1-16-13-17(2)15-19(14-16)22(26)24(11-6-5-7-12-24)25-23(27)20-9-8-10-21(28-4)18(20)3/h8-10,13-15H,5-7,11-12H2,1-4H3,(H,25,27)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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PubMed
n/an/an/an/a 1.41E+3n/an/an/an/a



RHeoGene

Curated by ChEMBL


Assay Description
Dose affording 50% of maximum transactivation for ecdysone receptor from Bombyx mori (BmEcR) and a beta-galactosidase reporter gene in HEK-293 cell-l...


Bioorg Med Chem Lett 13: 1883-6 (2003)

More data for this
Ligand-Target Pair
Ecdysone receptor


(Choristoneura fumiferana)
BDBM50128301
PNG
(CHEMBL54575 | N-[1-(3,5-Dimethyl-benzoyl)-cyclobut...)
Show SMILES COc1cccc(C(=O)NC2(CCC2)C(=O)c2cc(C)cc(C)c2)c1C
Show InChI InChI=1S/C22H25NO3/c1-14-11-15(2)13-17(12-14)20(24)22(9-6-10-22)23-21(25)18-7-5-8-19(26-4)16(18)3/h5,7-8,11-13H,6,9-10H2,1-4H3,(H,23,25)
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n/an/an/an/a 1.00E+4n/an/an/an/a



RHeoGene

Curated by ChEMBL


Assay Description
Dose affording 50% of maximum transactivation for ecdysone receptor from Choristoneura fumiferana (CfEcR) and a luciferase reporter gene in CHO cells


Bioorg Med Chem Lett 13: 1883-6 (2003)

More data for this
Ligand-Target Pair
Ecdysone receptor


(Bombyx mori)
BDBM50128301
PNG
(CHEMBL54575 | N-[1-(3,5-Dimethyl-benzoyl)-cyclobut...)
Show SMILES COc1cccc(C(=O)NC2(CCC2)C(=O)c2cc(C)cc(C)c2)c1C
Show InChI InChI=1S/C22H25NO3/c1-14-11-15(2)13-17(12-14)20(24)22(9-6-10-22)23-21(25)18-7-5-8-19(26-4)16(18)3/h5,7-8,11-13H,6,9-10H2,1-4H3,(H,23,25)
PDB
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KEGG

UniProtKB/SwissProt

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n/an/an/an/a 8.52E+3n/an/an/an/a



RHeoGene

Curated by ChEMBL


Assay Description
Dose affording 50% of maximum transactivation for ecdysone receptor from Bombyx mori (BmEcR) and a beta-galactosidase reporter gene in HEK-293 cell-l...


Bioorg Med Chem Lett 13: 1883-6 (2003)

More data for this
Ligand-Target Pair
Ecdysone receptor


(Bombyx mori)
BDBM50128302
PNG
(CHEMBL59044 | N-[1-(3,5-Dimethyl-benzoyl)-cyclohex...)
Show SMILES CCc1c(OC)cccc1C(=O)NC1(CCCCC1)C(=O)c1cc(C)cc(C)c1
Show InChI InChI=1S/C25H31NO3/c1-5-20-21(10-9-11-22(20)29-4)24(28)26-25(12-7-6-8-13-25)23(27)19-15-17(2)14-18(3)16-19/h9-11,14-16H,5-8,12-13H2,1-4H3,(H,26,28)
PDB
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KEGG

UniProtKB/SwissProt

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n/an/an/an/a 1.81E+3n/an/an/an/a



RHeoGene

Curated by ChEMBL


Assay Description
Dose affording 50% of maximum transactivation for ecdysone receptor from Bombyx mori (BmEcR) and a beta-galactosidase reporter gene in HEK-293 cell-l...


Bioorg Med Chem Lett 13: 1883-6 (2003)

More data for this
Ligand-Target Pair
Ecdysone receptor


(Choristoneura fumiferana)
BDBM50128313
PNG
(CHEMBL57543 | N-[1-(3,5-Dimethyl-benzoyl)-cyclopen...)
Show SMILES COc1cccc(C(=O)NC2(CCCC2)C(=O)c2cc(C)cc(C)c2)c1C
Show InChI InChI=1S/C23H27NO3/c1-15-12-16(2)14-18(13-15)21(25)23(10-5-6-11-23)24-22(26)19-8-7-9-20(27-4)17(19)3/h7-9,12-14H,5-6,10-11H2,1-4H3,(H,24,26)
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n/an/an/an/a 1.91E+3n/an/an/an/a



RHeoGene

Curated by ChEMBL


Assay Description
Dose affording 50% of maximum transactivation for ecdysone receptor from Choristoneura fumiferana (CfEcR) and a luciferase reporter gene in CHO cells


Bioorg Med Chem Lett 13: 1883-6 (2003)

More data for this
Ligand-Target Pair
Ecdysone receptor


(Choristoneura fumiferana)
BDBM50128302
PNG
(CHEMBL59044 | N-[1-(3,5-Dimethyl-benzoyl)-cyclohex...)
Show SMILES CCc1c(OC)cccc1C(=O)NC1(CCCCC1)C(=O)c1cc(C)cc(C)c1
Show InChI InChI=1S/C25H31NO3/c1-5-20-21(10-9-11-22(20)29-4)24(28)26-25(12-7-6-8-13-25)23(27)19-15-17(2)14-18(3)16-19/h9-11,14-16H,5-8,12-13H2,1-4H3,(H,26,28)
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n/an/an/an/a 1.25E+3n/an/an/an/a



RHeoGene

Curated by ChEMBL


Assay Description
Dose affording 50% of maximum transactivation for ecdysone receptor from Choristoneura fumiferana (CfEcR) and a luciferase reporter gene in CHO cells


Bioorg Med Chem Lett 13: 1883-6 (2003)

More data for this
Ligand-Target Pair
Ecdysone receptor


(Choristoneura fumiferana)
BDBM50128300
PNG
(CHEMBL55869 | N-[1-(3,5-Dimethyl-benzoyl)-cyclohex...)
Show SMILES COc1cccc(C(=O)NC2(CCCCC2)C(=O)c2cc(C)cc(C)c2)c1C
Show InChI InChI=1S/C24H29NO3/c1-16-13-17(2)15-19(14-16)22(26)24(11-6-5-7-12-24)25-23(27)20-9-8-10-21(28-4)18(20)3/h8-10,13-15H,5-7,11-12H2,1-4H3,(H,25,27)
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n/an/an/an/a 1.11E+3n/an/an/an/a



RHeoGene

Curated by ChEMBL


Assay Description
Dose affording 50% of maximum transactivation for ecdysone receptor from Choristoneura fumiferana (CfEcR) and a luciferase reporter gene in CHO cells


Bioorg Med Chem Lett 13: 1883-6 (2003)

More data for this
Ligand-Target Pair
Ecdysone receptor


(Bombyx mori)
BDBM50128313
PNG
(CHEMBL57543 | N-[1-(3,5-Dimethyl-benzoyl)-cyclopen...)
Show SMILES COc1cccc(C(=O)NC2(CCCC2)C(=O)c2cc(C)cc(C)c2)c1C
Show InChI InChI=1S/C23H27NO3/c1-15-12-16(2)14-18(13-15)21(25)23(10-5-6-11-23)24-22(26)19-8-7-9-20(27-4)17(19)3/h7-9,12-14H,5-6,10-11H2,1-4H3,(H,24,26)
PDB
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KEGG

UniProtKB/SwissProt

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n/an/an/an/a 1.87E+3n/an/an/an/a



RHeoGene

Curated by ChEMBL


Assay Description
Dose affording 50% of maximum transactivation for ecdysone receptor from Bombyx mori (BmEcR) and a beta-galactosidase reporter gene in HEK-293 cell-l...


Bioorg Med Chem Lett 13: 1883-6 (2003)

More data for this
Ligand-Target Pair
Ecdysone receptor


(Bombyx mori)
BDBM50128315
PNG
(CHEMBL300989 | N-[1-(3,5-Dimethyl-benzoyl)-cyclohe...)
Show SMILES COc1cccc(C(=O)NC2(CCCCCC2)C(=O)c2cc(C)cc(C)c2)c1C
Show InChI InChI=1S/C25H31NO3/c1-17-14-18(2)16-20(15-17)23(27)25(12-7-5-6-8-13-25)26-24(28)21-10-9-11-22(29-4)19(21)3/h9-11,14-16H,5-8,12-13H2,1-4H3,(H,26,28)
PDB
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KEGG

UniProtKB/SwissProt

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PubMed
n/an/an/an/a 1.61E+3n/an/an/an/a



RHeoGene

Curated by ChEMBL


Assay Description
Dose affording 50% of maximum transactivation for ecdysone receptor from Bombyx mori (BmEcR) and a beta-galactosidase reporter gene in HEK-293 cell-l...


Bioorg Med Chem Lett 13: 1883-6 (2003)

More data for this
Ligand-Target Pair
Ecdysone receptor


(Choristoneura fumiferana)
BDBM50128315
PNG
(CHEMBL300989 | N-[1-(3,5-Dimethyl-benzoyl)-cyclohe...)
Show SMILES COc1cccc(C(=O)NC2(CCCCCC2)C(=O)c2cc(C)cc(C)c2)c1C
Show InChI InChI=1S/C25H31NO3/c1-17-14-18(2)16-20(15-17)23(27)25(12-7-5-6-8-13-25)26-24(28)21-10-9-11-22(29-4)19(21)3/h9-11,14-16H,5-8,12-13H2,1-4H3,(H,26,28)
PDB
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n/an/an/an/a 2.97E+3n/an/an/an/a



RHeoGene

Curated by ChEMBL


Assay Description
Dose affording 50% of maximum transactivation for ecdysone receptor from Choristoneura fumiferana (CfEcR) and a luciferase reporter gene in CHO cells


Bioorg Med Chem Lett 13: 1883-6 (2003)

More data for this
Ligand-Target Pair
Ecdysone receptor


(Bombyx mori)
BDBM50128297
PNG
(5-Ethyl-2,3-dihydro-benzo[1,4]dioxine-6-carboxylic...)
Show SMILES CCc1c2OCCOc2ccc1C(=O)NC1(CCCCC1)C(=O)c1cc(C)cc(C)c1
Show InChI InChI=1S/C26H31NO4/c1-4-20-21(8-9-22-23(20)31-13-12-30-22)25(29)27-26(10-6-5-7-11-26)24(28)19-15-17(2)14-18(3)16-19/h8-9,14-16H,4-7,10-13H2,1-3H3,(H,27,29)
PDB
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KEGG

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PubMed
n/an/an/an/a 740n/an/an/an/a



RHeoGene

Curated by ChEMBL


Assay Description
Dose affording 50% of maximum transactivation for ecdysone receptor from Bombyx mori (BmEcR) and a beta-galactosidase reporter gene in HEK-293 cell-l...


Bioorg Med Chem Lett 13: 1883-6 (2003)

More data for this
Ligand-Target Pair