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6 similar compounds to monomer 50071808

Compile data set for download or QSAR
Wt: 152.1
BDBM50139368
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Wt: 152.1
BDBM50241221
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Wt: 228.2
BDBM50253134
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Wt: 168.1
BDBM50249070
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Wt: 196.1
BDBM50294529
Wt: 166.1
BDBM50310718
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 50139368,50241221,50253134,50249070,50294529,50310718   
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
Solute carrier family 28 member 3


(Homo sapiens (Human))
BDBM50241221
PNG
(1-(2,4-dihydroxyphenyl)ethanone | 2',4'-dihydroxya...)
Show SMILES CC(=O)c1ccc(O)cc1O
Show InChI InChI=1S/C8H8O3/c1-5(9)7-3-2-6(10)4-8(7)11/h2-4,10-11H,1H3
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>1.00E+5n/an/an/an/an/an/an/an/a



University of Tennessee Health Sciences Center

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant CNT3 expressed in pig PK15NTD cells assessed as [3H]uridine uptake by beta-scintillation counter


Bioorg Med Chem Lett 19: 917-21 (2009)


Article DOI: 10.1016/j.bmcl.2008.11.112
BindingDB Entry DOI: 10.7270/Q2K07440
More data for this
Ligand-Target Pair
Solute carrier family 28 member 3


(Homo sapiens (Human))
BDBM50249070
PNG
(1-(2,4,6-trihydroxyphenyl)ethanone | 2, 4, 6-trihy...)
Show SMILES CC(=O)c1c(O)cc(O)cc1O
Show InChI InChI=1S/C8H8O4/c1-4(9)8-6(11)2-5(10)3-7(8)12/h2-3,10-12H,1H3
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>1.00E+5n/an/an/an/an/an/an/an/a



University of Tennessee Health Sciences Center

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant CNT3 expressed in pig PK15NTD cells assessed as [3H]uridine uptake by beta-scintillation counter


Bioorg Med Chem Lett 19: 917-21 (2009)


Article DOI: 10.1016/j.bmcl.2008.11.112
BindingDB Entry DOI: 10.7270/Q2K07440
More data for this
Ligand-Target Pair
Hormone-sensitive lipase (HSL)


(Rattus norvegicus (Rat))
BDBM50253134
PNG
((2-hydroxy-4-methoxyphenyl)(phenyl)methanone | 2-B...)
Show SMILES COc1ccc(C(=O)c2ccccc2)c(O)c1
Show InChI InChI=1S/C14H12O3/c1-17-11-7-8-12(13(15)9-11)14(16)10-5-3-2-4-6-10/h2-9,15H,1H3
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n/an/a 3.25E+3n/an/an/an/an/an/a



University of Jordan

Curated by ChEMBL


Assay Description
Inhibition of HSL in Wistar rat isolated fat cells by spectrophotometric assay


J Med Chem 51: 6478-94 (2008)


Article DOI: 10.1021/jm800718k
BindingDB Entry DOI: 10.7270/Q23778KJ
More data for this
Ligand-Target Pair
Neuronal proto-oncogene tyrosine-protein kinase Src


(Mus musculus (Mouse))
BDBM50249070
PNG
(1-(2,4,6-trihydroxyphenyl)ethanone | 2, 4, 6-trihy...)
Show SMILES CC(=O)c1c(O)cc(O)cc1O
Show InChI InChI=1S/C8H8O4/c1-4(9)8-6(11)2-5(10)3-7(8)12/h2-3,10-12H,1H3
PDB
MMDB

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n/an/a 1.95E+5n/an/an/an/an/an/a



Chinese Academy of Medical Sciences and Peking Union Medical College

Curated by ChEMBL


Assay Description
Inhibition of Src in mouse BV2 cells assessed as suppression of LPS-induced NO release preincubated for 1 hr followed by LPS addition measured after ...


J Med Chem 59: 9062-9079 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00976
BindingDB Entry DOI: 10.7270/Q2B56MP4
More data for this
Ligand-Target Pair
Protein-tyrosine phosphatase 1B


(Homo sapiens (Human))
BDBM50294529
PNG
(1-(2,6-dihydroxy-4-methoxy-3-methylphenyl)ethanone...)
Show SMILES COc1cc(O)c(C(C)=O)c(O)c1C
Show InChI InChI=1S/C10H12O4/c1-5-8(14-3)4-7(12)9(6(2)11)10(5)13/h4,12-13H,1-3H3
PDB
MMDB

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n/an/a>2.00E+5n/an/an/an/an/an/a



Silla University

Curated by ChEMBL


Assay Description
Inhibition of PTP1B


Bioorg Med Chem Lett 19: 2801-3 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.108
BindingDB Entry DOI: 10.7270/Q20P10ZF
More data for this
Ligand-Target Pair
Aldose reductase


(Rattus norvegicus)
BDBM50310718
PNG
(CHEMBL1079227 | paeonol)
Show SMILES COc1ccc(C(C)=O)c(O)c1
Show InChI InChI=1S/C9H10O3/c1-6(10)8-4-3-7(12-2)5-9(8)11/h3-5,11H,1-2H3
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n/an/a>5.00E+4n/an/an/an/an/an/a



Chungnam National University

Curated by ChEMBL


Assay Description
Inhibition of Sprague-Dawley rat lens alodse reductase by spectrofluorimetry


J Nat Prod 72: 1465-70 (2009)


Article DOI: 10.1021/np9002004
BindingDB Entry DOI: 10.7270/Q2WS8V57
More data for this
Ligand-Target Pair
Calcium channel


(RAT)
BDBM50310718
PNG
(CHEMBL1079227 | paeonol)
Show SMILES COc1ccc(C(C)=O)c(O)c1
Show InChI InChI=1S/C9H10O3/c1-6(10)8-4-3-7(12-2)5-9(8)11/h3-5,11H,1-2H3
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n/an/a 5.61E+5n/an/an/an/an/an/a



Jagiellonian University

Curated by ChEMBL


Assay Description
Inhibition of L-type calcium channel measured using whole-cell patch clamp in rat ventricular myocytes


J Appl Toxicol 32: 858-66 (2012)


Article DOI: 10.1002/jat.2784
BindingDB Entry DOI: 10.7270/Q2D79D5C
More data for this
Ligand-Target Pair
Tyrosinase


(Homo sapiens (Human))
BDBM50139368
PNG
(2-Hydroxy-4-methoxy-benzaldehyde | 2-hydroxy-4-met...)
Show SMILES COc1ccc(C=O)c(O)c1
Show InChI InChI=1S/C8H8O3/c1-11-7-3-2-6(5-9)8(10)4-7/h2-5,10H,1H3
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n/an/a 3.00E+4n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibitory activity of the compound was evaluated against the oxidation of L-3,4-dihydroxyphenylalanine (L-DOPA) catalyzed by mushroom tyrosinase


Bioorg Med Chem Lett 14: 681-3 (2004)


Article DOI: 10.1016/j.bmcl.2003.11.033
BindingDB Entry DOI: 10.7270/Q27S7N6X
More data for this
Ligand-Target Pair