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13 similar compounds to monomer 50011421

Compile data set for download or QSAR
Wt: 283.2
BDBM85570
Wt: 283.2
BDBM50011442
Purchase
Wt: 299.2
BDBM50011417
Wt: 283.2
BDBM50011427
Wt: 237.2
BDBM50011437
Wt: 312.2
BDBM50037398
Purchase
Wt: 312.2
BDBM50037404
Wt: 252.2
BDBM50037410
Wt: 252.2
BDBM50037413
Wt: 317.2
BDBM50159604
Wt: 317.2
BDBM50159605
Wt: 287.3
BDBM50159660
Wt: 283.2
BDBM50434567

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 21 hits for monomerid = 85570,50011442,50011417,50011427,50011437,50037398,50037404,50037410,50037413,50159604,50159605,50159660,50434567   
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
Aromatase (CYP19)


(Homo sapiens (Human))
BDBM85570
PNG
(7-Hydroxy-flavone, 5e)
Show SMILES Oc1ccc2c(c1)oc(cc2=O)-c1ccc(cc1)N(=O)=O
Show InChI InChI=1S/C15H9NO5/c17-11-5-6-12-13(18)8-14(21-15(12)7-11)9-1-3-10(4-2-9)16(19)20/h1-8,17H
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n/an/a>2.00E+4n/an/an/an/an/a37



Cardiff University



Assay Description
The classical 3H2O assay was used to measure the effect of the flavones on aromatase activity using human placental microsomes.


J Enzym Inhib 16: 417-24 (2001)


BindingDB Entry DOI: 10.7270/Q2FJ2FBS
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Sus scrofa)
BDBM50159605
PNG
(2-(4-Nitro-phenyl)-benzo[h]chromen-4-one | CHEMBL1...)
Show SMILES [O-][N+](=O)c1ccc(cc1)-c1cc(=O)c2ccc3ccccc3c2o1
Show InChI InChI=1S/C19H11NO4/c21-17-11-18(13-5-8-14(9-6-13)20(22)23)24-19-15-4-2-1-3-12(15)7-10-16(17)19/h1-11H
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n/an/a 37n/an/an/an/an/an/a



Guru Nanak Dev University

Curated by ChEMBL


Assay Description
Inhibition of porcine cholesterol esterase using para-nitrophenyl butyrate as substrate after 5 mins in presence of sodium taurocholate by spectropho...


Bioorg Med Chem Lett 27: 850-854 (2017)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase Lck


(Homo sapiens (Human))
BDBM50011427
PNG
(7-Hydroxy-2-(4-nitro-phenyl)-chromen-4-one | 7-hyd...)
Show SMILES Oc1ccc2c(c1)oc(cc2=O)-c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C15H9NO5/c17-11-5-6-12-13(18)8-14(21-15(12)7-11)9-1-3-10(4-2-9)16(19)20/h1-8,17H
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n/an/a>2.00E+6n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Ability to inhibit protein-tyrosine kinase activity of p56lck (isolated from bovine thymus) in vitro.


J Med Chem 34: 798-806 (1991)


Article DOI: 10.1021/jm00106a047
BindingDB Entry DOI: 10.7270/Q2CF9P3J
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Lck


(Homo sapiens (Human))
BDBM50011437
PNG
(2-(4-Amino-phenyl)-chromen-4-one | 2-(4-aminopheny...)
Show SMILES Nc1ccc(cc1)-c1cc(=O)c2ccccc2o1
Show InChI InChI=1S/C15H11NO2/c16-11-7-5-10(6-8-11)15-9-13(17)12-3-1-2-4-14(12)18-15/h1-9H,16H2
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n/an/a 2.10E+5n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Ability to inhibit protein-tyrosine kinase activity of p56lck (isolated from bovine thymus) in vitro.


J Med Chem 34: 798-806 (1991)


Article DOI: 10.1021/jm00106a047
BindingDB Entry DOI: 10.7270/Q2CF9P3J
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Lck


(Homo sapiens (Human))
BDBM50011442
PNG
(6-Hydroxy-2-(4-nitro-phenyl)-chromen-4-one | 6-hyd...)
Show SMILES Oc1ccc2oc(cc(=O)c2c1)-c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C15H9NO5/c17-11-5-6-14-12(7-11)13(18)8-15(21-14)9-1-3-10(4-2-9)16(19)20/h1-8,17H
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n/an/a>2.00E+6n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Ability to inhibit protein-tyrosine kinase activity of p56lck (isolated from bovine thymus) in vitro.


J Med Chem 34: 798-806 (1991)


Article DOI: 10.1021/jm00106a047
BindingDB Entry DOI: 10.7270/Q2CF9P3J
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Lck


(Homo sapiens (Human))
BDBM50037398
PNG
(6-Nitro-2-(4-nitro-phenyl)-chromen-4-one | CHEMBL6...)
Show SMILES [O-][N+](=O)c1ccc(cc1)-c1cc(=O)c2cc(ccc2o1)[N+]([O-])=O
Show InChI InChI=1S/C15H8N2O6/c18-13-8-15(9-1-3-10(4-2-9)16(19)20)23-14-6-5-11(17(21)22)7-12(13)14/h1-8H
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n/an/a>2.00E+6n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
In vitro inhibition of protein-tyrosine activity of p56lck enzyme in presence of 50 uM ATP


J Med Chem 37: 3353-62 (1994)


Article DOI: 10.1021/jm00046a020
BindingDB Entry DOI: 10.7270/Q2D21WNP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Lck


(Homo sapiens (Human))
BDBM50037404
PNG
(8-Nitro-2-(4-nitro-phenyl)-chromen-4-one | CHEMBL3...)
Show SMILES [O-][N+](=O)c1ccc(cc1)-c1cc(=O)c2cccc([N+]([O-])=O)c2o1
Show InChI InChI=1S/C15H8N2O6/c18-13-8-14(9-4-6-10(7-5-9)16(19)20)23-15-11(13)2-1-3-12(15)17(21)22/h1-8H
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n/an/a>2.00E+6n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
In vitro inhibition of protein-tyrosine activity of p56lck enzyme in presence of 50 uM ATP


J Med Chem 37: 3353-62 (1994)


Article DOI: 10.1021/jm00046a020
BindingDB Entry DOI: 10.7270/Q2D21WNP
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50037410
PNG
(8-Amino-2-(4-amino-phenyl)-chromen-4-one | CHEMBL3...)
Show SMILES Nc1ccc(cc1)-c1cc(=O)c2cccc(N)c2o1
Show InChI InChI=1S/C15H12N2O2/c16-10-6-4-9(5-7-10)14-8-13(18)11-2-1-3-12(17)15(11)19-14/h1-8H,16-17H2
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n/an/a>1.00E+5n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of in vitro activity of EGFr enzyme from A431 cells in presence of 5 uM ATP


J Med Chem 37: 3353-62 (1994)


Article DOI: 10.1021/jm00046a020
BindingDB Entry DOI: 10.7270/Q2D21WNP
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50037413
PNG
(6-Amino-2-(4-amino-phenyl)-chromen-4-one | CHEMBL1...)
Show SMILES Nc1ccc(cc1)-c1cc(=O)c2cc(N)ccc2o1
Show InChI InChI=1S/C15H12N2O2/c16-10-3-1-9(2-4-10)15-8-13(18)12-7-11(17)5-6-14(12)19-15/h1-8H,16-17H2
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n/an/a 8.70E+3n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of in vitro activity of EGFr enzyme from A431 cells in presence of 5 uM ATP


J Med Chem 37: 3353-62 (1994)


Article DOI: 10.1021/jm00046a020
BindingDB Entry DOI: 10.7270/Q2D21WNP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Lck


(Homo sapiens (Human))
BDBM50037413
PNG
(6-Amino-2-(4-amino-phenyl)-chromen-4-one | CHEMBL1...)
Show SMILES Nc1ccc(cc1)-c1cc(=O)c2cc(N)ccc2o1
Show InChI InChI=1S/C15H12N2O2/c16-10-3-1-9(2-4-10)15-8-13(18)12-7-11(17)5-6-14(12)19-15/h1-8H,16-17H2
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n/an/a 1.03E+5n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
In vitro inhibition of protein-tyrosine activity of p56lck enzyme in presence of 50 uM ATP


J Med Chem 37: 3353-62 (1994)


Article DOI: 10.1021/jm00046a020
BindingDB Entry DOI: 10.7270/Q2D21WNP
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50037410
PNG
(8-Amino-2-(4-amino-phenyl)-chromen-4-one | CHEMBL3...)
Show SMILES Nc1ccc(cc1)-c1cc(=O)c2cccc(N)c2o1
Show InChI InChI=1S/C15H12N2O2/c16-10-6-4-9(5-7-10)14-8-13(18)11-2-1-3-12(17)15(11)19-14/h1-8H,16-17H2
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n/an/a>5.00E+4n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of in vitro protein-tyrosine kinase activity of p60v-src enzyme in presence of 5 uM ATP.


J Med Chem 37: 3353-62 (1994)


Article DOI: 10.1021/jm00046a020
BindingDB Entry DOI: 10.7270/Q2D21WNP
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50037413
PNG
(6-Amino-2-(4-amino-phenyl)-chromen-4-one | CHEMBL1...)
Show SMILES Nc1ccc(cc1)-c1cc(=O)c2cc(N)ccc2o1
Show InChI InChI=1S/C15H12N2O2/c16-10-3-1-9(2-4-10)15-8-13(18)12-7-11(17)5-6-14(12)19-15/h1-8H,16-17H2
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n/an/a 2.88E+4n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Inhibition of in vitro protein-tyrosine kinase activity of p60v-src enzyme in presence of 5 uM ATP.


J Med Chem 37: 3353-62 (1994)


Article DOI: 10.1021/jm00046a020
BindingDB Entry DOI: 10.7270/Q2D21WNP
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Lck


(Homo sapiens (Human))
BDBM50037410
PNG
(8-Amino-2-(4-amino-phenyl)-chromen-4-one | CHEMBL3...)
Show SMILES Nc1ccc(cc1)-c1cc(=O)c2cccc(N)c2o1
Show InChI InChI=1S/C15H12N2O2/c16-10-6-4-9(5-7-10)14-8-13(18)11-2-1-3-12(17)15(11)19-14/h1-8H,16-17H2
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n/an/a 1.23E+5n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
In vitro inhibition of protein-tyrosine activity of p56lck enzyme in presence of 50 uM ATP


J Med Chem 37: 3353-62 (1994)


Article DOI: 10.1021/jm00046a020
BindingDB Entry DOI: 10.7270/Q2D21WNP
More data for this
Ligand-Target Pair
DNA-dependent protein kinase


(Homo sapiens (Human))
BDBM50159605
PNG
(2-(4-Nitro-phenyl)-benzo[h]chromen-4-one | CHEMBL1...)
Show SMILES [O-][N+](=O)c1ccc(cc1)-c1cc(=O)c2ccc3ccccc3c2o1
Show InChI InChI=1S/C19H11NO4/c21-17-11-18(13-5-8-14(9-6-13)20(22)23)24-19-15-4-2-1-3-12(15)7-10-16(17)19/h1-11H
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n/an/a>1.00E+4n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase


(Homo sapiens (Human))
BDBM50159660
PNG
(2-(4-Amino-phenyl)-benzo[h]chromen-4-one | CHEMBL1...)
Show SMILES Nc1ccc(cc1)-c1cc(=O)c2ccc3ccccc3c2o1
Show InChI InChI=1S/C19H13NO2/c20-14-8-5-13(6-9-14)18-11-17(21)16-10-7-12-3-1-2-4-15(12)19(16)22-18/h1-11H,20H2
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n/an/a 7.70E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase


(Homo sapiens (Human))
BDBM50159604
PNG
(2-(3-Nitro-phenyl)-benzo[h]chromen-4-one | CHEMBL1...)
Show SMILES [O-][N+](=O)c1cccc(c1)-c1cc(=O)c2ccc3ccccc3c2o1
Show InChI InChI=1S/C19H11NO4/c21-17-11-18(13-5-3-6-14(10-13)20(22)23)24-19-15-7-2-1-4-12(15)8-9-16(17)19/h1-11H
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n/an/a>1.00E+4n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Lck


(Homo sapiens (Human))
BDBM50011437
PNG
(2-(4-Amino-phenyl)-chromen-4-one | 2-(4-aminopheny...)
Show SMILES Nc1ccc(cc1)-c1cc(=O)c2ccccc2o1
Show InChI InChI=1S/C15H11NO2/c16-11-7-5-10(6-8-11)15-9-13(17)12-3-1-2-4-14(12)18-15/h1-9H,16H2
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n/an/a 2n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of p56 lck


J Nat Prod 55: 1529-1560 (1992)


Article DOI: 10.1021/np50089a001
BindingDB Entry DOI: 10.7270/Q2J966CC
More data for this
Ligand-Target Pair
Androgen Receptor


(Homo sapiens (Human))
BDBM50434567
PNG
(CHEMBL2386395)
Show SMILES Oc1cc(oc2cccc(=O)c12)-c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C15H9NO5/c17-11-2-1-3-13-15(11)12(18)8-14(21-13)9-4-6-10(7-5-9)16(19)20/h1-8,18H
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n/an/a 360n/an/an/an/an/an/a



Meijo University

Curated by ChEMBL


Assay Description
Antagonist activity at human androgen receptor LBD expressed in human MDA-kb2 cells by luciferase reporter gene assay


Bioorg Med Chem 21: 2968-74 (2013)


Article DOI: 10.1016/j.bmc.2013.03.060
BindingDB Entry DOI: 10.7270/Q2FT8NFN
More data for this
Ligand-Target Pair
Androgen Receptor


(Homo sapiens (Human))
BDBM50434567
PNG
(CHEMBL2386395)
Show SMILES Oc1cc(oc2cccc(=O)c12)-c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C15H9NO5/c17-11-2-1-3-13-15(11)12(18)8-14(21-13)9-4-6-10(7-5-9)16(19)20/h1-8,18H
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n/an/a 363n/an/an/an/an/an/a



Meijo University

Curated by ChEMBL


Assay Description
Antagonist activity at human androgen receptor LBD expressed in human MDA-kb2 cells by luciferase reporter gene assay


Bioorg Med Chem 21: 2968-74 (2013)


Article DOI: 10.1016/j.bmc.2013.03.060
BindingDB Entry DOI: 10.7270/Q2FT8NFN
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Sus scrofa)
BDBM50159604
PNG
(2-(3-Nitro-phenyl)-benzo[h]chromen-4-one | CHEMBL1...)
Show SMILES [O-][N+](=O)c1cccc(c1)-c1cc(=O)c2ccc3ccccc3c2o1
Show InChI InChI=1S/C19H11NO4/c21-17-11-18(13-5-3-6-14(10-13)20(22)23)24-19-15-7-2-1-4-12(15)8-9-16(17)19/h1-11H
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n/an/a 25n/an/an/an/an/an/a



Guru Nanak Dev University

Curated by ChEMBL


Assay Description
Inhibition of porcine cholesterol esterase using para-nitrophenyl butyrate as substrate after 5 mins in presence of sodium taurocholate by spectropho...


Bioorg Med Chem Lett 27: 850-854 (2017)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase Lck


(Homo sapiens (Human))
BDBM50011417
PNG
(5,7-Dihydroxy-2-(4-nitro-phenyl)-chromen-4-one | 5...)
Show SMILES Oc1cc(O)c2c(c1)oc(cc2=O)-c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C15H9NO6/c17-10-5-11(18)15-12(19)7-13(22-14(15)6-10)8-1-3-9(4-2-8)16(20)21/h1-7,17-18H
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n/an/a>2.00E+6n/an/an/an/an/an/a



Purdue University

Curated by ChEMBL


Assay Description
Ability to inhibit protein-tyrosine kinase activity of p56lck (isolated from bovine thymus) in vitro.


J Med Chem 34: 798-806 (1991)


Article DOI: 10.1021/jm00106a047
BindingDB Entry DOI: 10.7270/Q2CF9P3J
More data for this
Ligand-Target Pair