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13 similar compounds to monomer 50350499

Wt: 313.3
BDBM50306408
Wt: 327.3
BDBM50306358
Wt: 327.3
BDBM50306360
Wt: 299.3
BDBM50306397
Wt: 297.3
BDBM50306401
Wt: 309.3
BDBM50306402
Wt: 311.3
BDBM50306403
Wt: 311.3
BDBM50306404
Wt: 283.3
BDBM50306405
Wt: 335.4
BDBM50350486
Wt: 251.3
BDBM50350487
Wt: 223.2
BDBM50350488
Purchase
Wt: 222.2
BDBM50382976

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 22 hits for monomerid = 50306408,50306358,50306360,50306397,50306401,50306402,50306403,50306404,50306405,50350486,50350487,50350488,50382976   
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
CDGSH iron-sulfur domain-containing protein 1


(Homo sapiens)
BDBM50350486
PNG
(CHEMBL602048)
Show SMILES CC(C)(C)c1cc(Cc2sc(=O)[nH]c2O)cc(c1O)C(C)(C)C
Show InChI InChI=1S/C18H25NO3S/c1-17(2,3)11-7-10(8-12(14(11)20)18(4,5)6)9-13-15(21)19-16(22)23-13/h7-8,20-21H,9H2,1-6H3,(H,19,22)
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315n/an/an/an/an/an/an/an/a



West Virginia University

Curated by ChEMBL


Assay Description
Displacement of [3H]rosiglitazone from recombinant human C-terminal His-tagged MitoNEET cytosolic domain (32 to 108 residues) expressed in Escherichi...


Citation and Details
More data for this
Ligand-Target Pair
CDGSH iron-sulfur domain-containing protein 1


(Homo sapiens)
BDBM50350488
PNG
(CHEMBL1061)
Show SMILES Oc1[nH]c(=O)sc1Cc1ccc(O)cc1
Show InChI InChI=1S/C10H9NO3S/c12-7-3-1-6(2-4-7)5-8-9(13)11-10(14)15-8/h1-4,12-13H,5H2,(H,11,14)
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598n/an/an/an/an/an/an/an/a



West Virginia University

Curated by ChEMBL


Assay Description
Displacement of [3H]rosiglitazone from recombinant human C-terminal His-tagged MitoNEET cytosolic domain (32 to 108 residues) expressed in Escherichi...


Citation and Details
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (human))
BDBM50382976
PNG
(CHEMBL2030680)
Show SMILES Nc1cccc(Cc2sc(=O)[nH]c2O)c1
Show InChI InChI=1S/C10H10N2O2S/c11-7-3-1-2-6(4-7)5-8-9(13)12-10(14)15-8/h1-4,13H,5,11H2,(H,12,14)
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7.08E+3n/an/an/an/an/an/an/an/a



Heptares Therapeutics Limited

Curated by ChEMBL


Assay Description
Displacement of [3H]ZM241385 from human A2A receptor expressed in HEK293 cells after 1 hr by liquid scintillation counting


J Med Chem 55: 1904-9 (2012)

More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50306402
PNG
(5-(4-styrylbenzyl)thiazolidine-2,4-dione | CHEMBL5...)
Show SMILES Oc1[nH]c(=O)sc1Cc1ccc(\C=C\c2ccccc2)cc1
Show InChI InChI=1S/C18H15NO2S/c20-17-16(22-18(21)19-17)12-15-10-8-14(9-11-15)7-6-13-4-2-1-3-5-13/h1-11,20H,12H2,(H,19,21)/b7-6+
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n/an/an/an/a 2.09E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 by FLIPR assay in presence of 1% BSA


Bioorg Med Chem Lett 20: 1298-301 (2010)

More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50306403
PNG
(5-(4-phenethylbenzyl)thiazolidine-2,4-dione | CHEM...)
Show SMILES Oc1[nH]c(=O)sc1Cc1ccc(CCc2ccccc2)cc1
Show InChI InChI=1S/C18H17NO2S/c20-17-16(22-18(21)19-17)12-15-10-8-14(9-11-15)7-6-13-4-2-1-3-5-13/h1-5,8-11,20H,6-7,12H2,(H,19,21)
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n/an/an/an/a 1.08E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 by FLIPR assay in presence of 1% BSA


Bioorg Med Chem Lett 20: 1298-301 (2010)

More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50306404
PNG
(5-(4-benzoylbenzyl)thiazolidine-2,4-dione | CHEMBL...)
Show SMILES Oc1[nH]c(=O)sc1Cc1ccc(cc1)C(=O)c1ccccc1
Show InChI InChI=1S/C17H13NO3S/c19-15(12-4-2-1-3-5-12)13-8-6-11(7-9-13)10-14-16(20)18-17(21)22-14/h1-9,20H,10H2,(H,18,21)
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n/an/an/an/a 5.30E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 by FLIPR assay in presence of 1% BSA


Bioorg Med Chem Lett 20: 1298-301 (2010)

More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50306405
PNG
(5-(biphenyl-4-ylmethyl)thiazolidine-2,4-dione | CH...)
Show SMILES Oc1[nH]c(=O)sc1Cc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C16H13NO2S/c18-15-14(20-16(19)17-15)10-11-6-8-13(9-7-11)12-4-2-1-3-5-12/h1-9,18H,10H2,(H,17,19)
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n/an/an/an/a 2.22E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 by FLIPR assay in presence of 1% BSA


Bioorg Med Chem Lett 20: 1298-301 (2010)

More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50306408
PNG
(5-(4-(p-tolyloxy)benzyl)thiazolidine-2,4-dione | C...)
Show SMILES Cc1ccc(Oc2ccc(Cc3sc(=O)[nH]c3O)cc2)cc1
Show InChI InChI=1S/C17H15NO3S/c1-11-2-6-13(7-3-11)21-14-8-4-12(5-9-14)10-15-16(19)18-17(20)22-15/h2-9,19H,10H2,1H3,(H,18,20)
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n/an/an/an/a 547n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 by FLIPR assay in presence of 1% BSA


Bioorg Med Chem Lett 20: 1298-301 (2010)

More data for this
Ligand-Target Pair
CDGSH iron-sulfur domain-containing protein 1


(Homo sapiens)
BDBM50350486
PNG
(CHEMBL602048)
Show SMILES CC(C)(C)c1cc(Cc2sc(=O)[nH]c2O)cc(c1O)C(C)(C)C
Show InChI InChI=1S/C18H25NO3S/c1-17(2,3)11-7-10(8-12(14(11)20)18(4,5)6)9-13-15(21)19-16(22)23-13/h7-8,20-21H,9H2,1-6H3,(H,19,22)
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n/an/a 7.36E+3n/an/an/an/an/an/a



Northeast Ohio Medical University

Curated by ChEMBL


Assay Description
Displacement of [3H]-rosiglitazone from human recombinant C-terminal His-tagged cytosolic domain of mitoNEET (32-108) by scintillation proximity assa...


Bioorg Med Chem Lett 21: 5498-501 (2011)

More data for this
Ligand-Target Pair
CDGSH iron-sulfur domain-containing protein 1


(Homo sapiens)
BDBM50350487
PNG
(CHEMBL1814635)
Show SMILES Cc1cc(Cc2sc(=O)[nH]c2O)cc(C)c1O
Show InChI InChI=1S/C12H13NO3S/c1-6-3-8(4-7(2)10(6)14)5-9-11(15)13-12(16)17-9/h3-4,14-15H,5H2,1-2H3,(H,13,16)
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n/an/a 9.56E+3n/an/an/an/an/an/a



Northeast Ohio Medical University

Curated by ChEMBL


Assay Description
Displacement of [3H]-rosiglitazone from human recombinant C-terminal His-tagged cytosolic domain of mitoNEET (32-108) by scintillation proximity assa...


Bioorg Med Chem Lett 21: 5498-501 (2011)

More data for this
Ligand-Target Pair
CDGSH iron-sulfur domain-containing protein 1


(Homo sapiens)
BDBM50350488
PNG
(CHEMBL1061)
Show SMILES Oc1[nH]c(=O)sc1Cc1ccc(O)cc1
Show InChI InChI=1S/C10H9NO3S/c12-7-3-1-6(2-4-7)5-8-9(13)11-10(14)15-8/h1-4,12-13H,5H2,(H,11,14)
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n/an/a 1.40E+4n/an/an/an/an/an/a



Northeast Ohio Medical University

Curated by ChEMBL


Assay Description
Displacement of [3H]-rosiglitazone from human recombinant C-terminal His-tagged cytosolic domain of mitoNEET (32-108) by scintillation proximity assa...


Bioorg Med Chem Lett 21: 5498-501 (2011)

More data for this
Ligand-Target Pair
Monoamine oxidase type B (MAO-B)


(Homo sapiens (Human))
BDBM50350486
PNG
(CHEMBL602048)
Show SMILES CC(C)(C)c1cc(Cc2sc(=O)[nH]c2O)cc(c1O)C(C)(C)C
Show InChI InChI=1S/C18H25NO3S/c1-17(2,3)11-7-10(8-12(14(11)20)18(4,5)6)9-13-15(21)19-16(22)23-13/h7-8,20-21H,9H2,1-6H3,(H,19,22)
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n/an/a 2.38E+3n/an/an/an/an/an/a



Northeastern Ohio Universities Colleges of Medicine and Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB by amplex red assay


Bioorg Med Chem Lett 21: 4798-803 (2011)

More data for this
Ligand-Target Pair
Monoamine oxidase type B (MAO-B)


(Homo sapiens (Human))
BDBM50350487
PNG
(CHEMBL1814635)
Show SMILES Cc1cc(Cc2sc(=O)[nH]c2O)cc(C)c1O
Show InChI InChI=1S/C12H13NO3S/c1-6-3-8(4-7(2)10(6)14)5-9-11(15)13-12(16)17-9/h3-4,14-15H,5H2,1-2H3,(H,13,16)
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n/an/a 1.61E+4n/an/an/an/an/an/a



Northeastern Ohio Universities Colleges of Medicine and Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB by amplex red assay


Bioorg Med Chem Lett 21: 4798-803 (2011)

More data for this
Ligand-Target Pair
Monoamine oxidase type B (MAO-B)


(Homo sapiens (Human))
BDBM50350488
PNG
(CHEMBL1061)
Show SMILES Oc1[nH]c(=O)sc1Cc1ccc(O)cc1
Show InChI InChI=1S/C10H9NO3S/c12-7-3-1-6(2-4-7)5-8-9(13)11-10(14)15-8/h1-4,12-13H,5H2,(H,11,14)
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n/an/a 2.25E+5n/an/an/an/an/an/a



Northeastern Ohio Universities Colleges of Medicine and Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOB by amplex red assay


Bioorg Med Chem Lett 21: 4798-803 (2011)

More data for this
Ligand-Target Pair
Monoamine oxidase type A (MAO-A)


(Homo sapiens (Human))
BDBM50350487
PNG
(CHEMBL1814635)
Show SMILES Cc1cc(Cc2sc(=O)[nH]c2O)cc(C)c1O
Show InChI InChI=1S/C12H13NO3S/c1-6-3-8(4-7(2)10(6)14)5-9-11(15)13-12(16)17-9/h3-4,14-15H,5H2,1-2H3,(H,13,16)
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n/an/a 2.62E+4n/an/an/an/an/an/a



Northeastern Ohio Universities Colleges of Medicine and Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOA assessed as inhibition of kynuramine conversion to fluorescent metabolite 4-hydroxyquinoline by fluorimetry


Bioorg Med Chem Lett 21: 4798-803 (2011)

More data for this
Ligand-Target Pair
Monoamine oxidase type A (MAO-A)


(Homo sapiens (Human))
BDBM50350488
PNG
(CHEMBL1061)
Show SMILES Oc1[nH]c(=O)sc1Cc1ccc(O)cc1
Show InChI InChI=1S/C10H9NO3S/c12-7-3-1-6(2-4-7)5-8-9(13)11-10(14)15-8/h1-4,12-13H,5H2,(H,11,14)
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n/an/a 1.94E+5n/an/an/an/an/an/a



Northeastern Ohio Universities Colleges of Medicine and Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MAOA assessed as inhibition of kynuramine conversion to fluorescent metabolite 4-hydroxyquinoline by fluorimetry


Bioorg Med Chem Lett 21: 4798-803 (2011)

More data for this
Ligand-Target Pair
CDGSH iron-sulfur domain-containing protein 1


(Homo sapiens)
BDBM50350488
PNG
(CHEMBL1061)
Show SMILES Oc1[nH]c(=O)sc1Cc1ccc(O)cc1
Show InChI InChI=1S/C10H9NO3S/c12-7-3-1-6(2-4-7)5-8-9(13)11-10(14)15-8/h1-4,12-13H,5H2,(H,11,14)
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n/an/a 1.40E+4n/an/an/an/an/an/a



West Virginia University

Curated by ChEMBL


Assay Description
Displacement of [3H]rosiglitazone from recombinant human C-terminal His-tagged MitoNEET cytosolic domain (32 to 108 residues) expressed in Escherichi...


Citation and Details
More data for this
Ligand-Target Pair
CDGSH iron-sulfur domain-containing protein 1


(Homo sapiens)
BDBM50350486
PNG
(CHEMBL602048)
Show SMILES CC(C)(C)c1cc(Cc2sc(=O)[nH]c2O)cc(c1O)C(C)(C)C
Show InChI InChI=1S/C18H25NO3S/c1-17(2,3)11-7-10(8-12(14(11)20)18(4,5)6)9-13-15(21)19-16(22)23-13/h7-8,20-21H,9H2,1-6H3,(H,19,22)
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n/an/a 7.36E+3n/an/an/an/an/an/a



West Virginia University

Curated by ChEMBL


Assay Description
Displacement of [3H]rosiglitazone from recombinant human C-terminal His-tagged MitoNEET cytosolic domain (32 to 108 residues) expressed in Escherichi...


Citation and Details
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50306401
PNG
(5-(4-benzylbenzyl)thiazolidine-2,4-dione | CHEMBL5...)
Show SMILES Oc1[nH]c(=O)sc1Cc1ccc(Cc2ccccc2)cc1
Show InChI InChI=1S/C17H15NO2S/c19-16-15(21-17(20)18-16)11-14-8-6-13(7-9-14)10-12-4-2-1-3-5-12/h1-9,19H,10-11H2,(H,18,20)
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n/an/an/an/a 9.28E+3n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 by FLIPR assay in presence of 1% BSA


Bioorg Med Chem Lett 20: 1298-301 (2010)

More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50306397
PNG
(5-(4-phenoxybenzyl)thiazolidine-2,4-dione | CHEMBL...)
Show SMILES Oc1[nH]c(=O)sc1Cc1ccc(Oc2ccccc2)cc1
Show InChI InChI=1S/C16H13NO3S/c18-15-14(21-16(19)17-15)10-11-6-8-13(9-7-11)20-12-4-2-1-3-5-12/h1-9,18H,10H2,(H,17,19)
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n/an/an/an/a 307n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 by FLIPR assay in presence of 1% BSA


Bioorg Med Chem Lett 20: 1298-301 (2010)

More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50306358
PNG
(5-(4-(3,5-dimethylphenoxy)benzyl)thiazolidine-2,4-...)
Show SMILES Cc1cc(C)cc(Oc2ccc(Cc3sc(=O)[nH]c3O)cc2)c1
Show InChI InChI=1S/C18H17NO3S/c1-11-7-12(2)9-15(8-11)22-14-5-3-13(4-6-14)10-16-17(20)19-18(21)23-16/h3-9,20H,10H2,1-2H3,(H,19,21)
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n/an/an/an/a 96n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 by FLIPR assay in presence of 1% BSA


Bioorg Med Chem Lett 20: 1298-301 (2010)

More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50306360
PNG
(5-(4-(2,4-dimethylphenoxy)benzyl)thiazolidine-2,4-...)
Show SMILES Cc1ccc(Oc2ccc(Cc3sc(=O)[nH]c3O)cc2)c(C)c1
Show InChI InChI=1S/C18H17NO3S/c1-11-3-8-15(12(2)9-11)22-14-6-4-13(5-7-14)10-16-17(20)19-18(21)23-16/h3-9,20H,10H2,1-2H3,(H,19,21)
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n/an/an/an/a 121n/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 by FLIPR assay in presence of 1% BSA


Bioorg Med Chem Lett 20: 1298-301 (2010)

More data for this
Ligand-Target Pair