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Compile Data Set for Download or QSAR

Found 27 hits Enz. Inhib. hit(s) with Target = 'N-acetyltransferase Eis'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
N-acetyltransferase Eis


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
BDBM50201765
PNG
(CHEMBL3931070)
Show SMILES Clc1cccc(c1)C(=O)CN1C(=O)C2(OCCO2)c2ccccc12
Show InChI InChI=1S/C18H14ClNO4/c19-13-5-3-4-12(10-13)16(21)11-20-15-7-2-1-6-14(15)18(17(20)22)23-8-9-24-18/h1-7,10H,8-9,11H2
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n/an/a 15n/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis H37Rv Eis expressed in Escherichia coli BL21(DE3) using Acetyl-CoA as substrate preincubated for 10 mins fol...


ACS Med Chem Lett 7: 1219-1221 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00261
BindingDB Entry DOI: 10.7270/Q2251M51
More data for this
Ligand-Target Pair
N-acetyltransferase Eis


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
BDBM50201755
PNG
(CHEMBL1410785)
Show SMILES Fc1ccc(cc1)C(=O)CN1C(=O)C2(OCCO2)c2ccccc12
Show InChI InChI=1S/C18H14FNO4/c19-13-7-5-12(6-8-13)16(21)11-20-15-4-2-1-3-14(15)18(17(20)22)23-9-10-24-18/h1-8H,9-11H2
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n/an/a 90n/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis H37Rv Eis expressed in Escherichia coli BL21(DE3) using Acetyl-CoA as substrate preincubated for 10 mins fol...


ACS Med Chem Lett 7: 1219-1221 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00261
BindingDB Entry DOI: 10.7270/Q2251M51
More data for this
Ligand-Target Pair
N-acetyltransferase Eis


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
BDBM50201742
PNG
(CHEMBL3950034)
Show SMILES COC(=O)c1cc2occc2n1CC(=O)c1cccc(F)c1
Show InChI InChI=1S/C16H12FNO4/c1-21-16(20)13-8-15-12(5-6-22-15)18(13)9-14(19)10-3-2-4-11(17)7-10/h2-8H,9H2,1H3
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n/an/a 160n/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis H37Rv Eis expressed in Escherichia coli BL21(DE3) using Acetyl-CoA as substrate preincubated for 10 mins fol...


ACS Med Chem Lett 7: 1219-1221 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00261
BindingDB Entry DOI: 10.7270/Q2251M51
More data for this
Ligand-Target Pair
N-acetyltransferase Eis


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
BDBM50201746
PNG
(CHEMBL3976122)
Show SMILES COC(=O)c1cc2occc2n1CC(=O)c1cccc(Cl)c1
Show InChI InChI=1S/C16H12ClNO4/c1-21-16(20)13-8-15-12(5-6-22-15)18(13)9-14(19)10-3-2-4-11(17)7-10/h2-8H,9H2,1H3
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n/an/a 250n/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis H37Rv Eis expressed in Escherichia coli BL21(DE3) using Acetyl-CoA as substrate preincubated for 10 mins fol...


ACS Med Chem Lett 7: 1219-1221 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00261
BindingDB Entry DOI: 10.7270/Q2251M51
More data for this
Ligand-Target Pair
N-acetyltransferase Eis


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
BDBM50201747
PNG
(CHEMBL3960292)
Show SMILES COC(=O)c1cc2occc2n1CC(=O)c1ccc(F)cc1
Show InChI InChI=1S/C16H12FNO4/c1-21-16(20)13-8-15-12(6-7-22-15)18(13)9-14(19)10-2-4-11(17)5-3-10/h2-8H,9H2,1H3
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n/an/a 300n/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis H37Rv Eis expressed in Escherichia coli BL21(DE3) using Acetyl-CoA as substrate preincubated for 10 mins fol...


ACS Med Chem Lett 7: 1219-1221 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00261
BindingDB Entry DOI: 10.7270/Q2251M51
More data for this
Ligand-Target Pair
N-acetyltransferase Eis


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
BDBM50201750
PNG
(CHEMBL3903088)
Show SMILES Fc1cccc(c1)C(=O)CN1C(=O)C2(OCCO2)c2ccccc12
Show InChI InChI=1S/C18H14FNO4/c19-13-5-3-4-12(10-13)16(21)11-20-15-7-2-1-6-14(15)18(17(20)22)23-8-9-24-18/h1-7,10H,8-9,11H2
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n/an/a 300n/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis H37Rv Eis expressed in Escherichia coli BL21(DE3) using Acetyl-CoA as substrate preincubated for 10 mins fol...


ACS Med Chem Lett 7: 1219-1221 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00261
BindingDB Entry DOI: 10.7270/Q2251M51
More data for this
Ligand-Target Pair
N-acetyltransferase Eis


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
BDBM50201749
PNG
(CHEMBL3927142)
Show SMILES O=C(CN1C(=O)C2(OCCO2)c2ccccc12)c1ccccc1
Show InChI InChI=1S/C18H15NO4/c20-16(13-6-2-1-3-7-13)12-19-15-9-5-4-8-14(15)18(17(19)21)22-10-11-23-18/h1-9H,10-12H2
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n/an/a 330n/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis H37Rv Eis expressed in Escherichia coli BL21(DE3) using Acetyl-CoA as substrate preincubated for 10 mins fol...


ACS Med Chem Lett 7: 1219-1221 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00261
BindingDB Entry DOI: 10.7270/Q2251M51
More data for this
Ligand-Target Pair
N-acetyltransferase Eis


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
BDBM50201760
PNG
(CHEMBL3905343)
Show SMILES COC(=O)c1cc2occc2n1CC(=O)c1cccc(Br)c1
Show InChI InChI=1S/C16H12BrNO4/c1-21-16(20)13-8-15-12(5-6-22-15)18(13)9-14(19)10-3-2-4-11(17)7-10/h2-8H,9H2,1H3
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n/an/a 500n/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis H37Rv Eis expressed in Escherichia coli BL21(DE3) using Acetyl-CoA as substrate preincubated for 10 mins fol...


ACS Med Chem Lett 7: 1219-1221 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00261
BindingDB Entry DOI: 10.7270/Q2251M51
More data for this
Ligand-Target Pair
N-acetyltransferase Eis


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
BDBM50201759
PNG
(CHEMBL3927499)
Show SMILES Brc1cccc(c1)C(=O)CN1C(=O)C2(OCCO2)c2ccccc12
Show InChI InChI=1S/C18H14BrNO4/c19-13-5-3-4-12(10-13)16(21)11-20-15-7-2-1-6-14(15)18(17(20)22)23-8-9-24-18/h1-7,10H,8-9,11H2
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n/an/a 540n/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis H37Rv Eis expressed in Escherichia coli BL21(DE3) using Acetyl-CoA as substrate preincubated for 10 mins fol...


ACS Med Chem Lett 7: 1219-1221 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00261
BindingDB Entry DOI: 10.7270/Q2251M51
More data for this
Ligand-Target Pair
N-acetyltransferase Eis


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
BDBM50201756
PNG
(CHEMBL3980494)
Show SMILES COC(=O)c1cc2occc2n1CC(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C16H12ClNO4/c1-21-16(20)13-8-15-12(6-7-22-15)18(13)9-14(19)10-2-4-11(17)5-3-10/h2-8H,9H2,1H3
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n/an/a 600n/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis H37Rv Eis expressed in Escherichia coli BL21(DE3) using Acetyl-CoA as substrate preincubated for 10 mins fol...


ACS Med Chem Lett 7: 1219-1221 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00261
BindingDB Entry DOI: 10.7270/Q2251M51
More data for this
Ligand-Target Pair
N-acetyltransferase Eis


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
BDBM50201741
PNG
(CHEMBL3915019)
Show SMILES [O-][N+](=O)c1cccc(c1)C(=O)CN1C(=O)C2(OCCO2)c2ccccc12
Show InChI InChI=1S/C18H14N2O6/c21-16(12-4-3-5-13(10-12)20(23)24)11-19-15-7-2-1-6-14(15)18(17(19)22)25-8-9-26-18/h1-7,10H,8-9,11H2
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n/an/a 1.20E+3n/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis H37Rv Eis expressed in Escherichia coli BL21(DE3) using Acetyl-CoA as substrate preincubated for 10 mins fol...


ACS Med Chem Lett 7: 1219-1221 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00261
BindingDB Entry DOI: 10.7270/Q2251M51
More data for this
Ligand-Target Pair
N-acetyltransferase Eis


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
BDBM50201763
PNG
(CHEMBL1612166)
Show SMILES Clc1ccc(cc1)C(=O)CN1C(=O)C2(OCCO2)c2ccccc12
Show InChI InChI=1S/C18H14ClNO4/c19-13-7-5-12(6-8-13)16(21)11-20-15-4-2-1-3-14(15)18(17(20)22)23-9-10-24-18/h1-8H,9-11H2
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n/an/a 2.20E+3n/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis H37Rv Eis expressed in Escherichia coli BL21(DE3) using Acetyl-CoA as substrate preincubated for 10 mins fol...


ACS Med Chem Lett 7: 1219-1221 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00261
BindingDB Entry DOI: 10.7270/Q2251M51
More data for this
Ligand-Target Pair
N-acetyltransferase Eis


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
BDBM50201745
PNG
(CHEMBL3926253)
Show SMILES COC(=O)c1cc2occc2n1CC(=O)c1ccccc1F
Show InChI InChI=1S/C16H12FNO4/c1-21-16(20)13-8-15-12(6-7-22-15)18(13)9-14(19)10-4-2-3-5-11(10)17/h2-8H,9H2,1H3
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n/an/a 2.90E+3n/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis H37Rv Eis expressed in Escherichia coli BL21(DE3) using Acetyl-CoA as substrate preincubated for 10 mins fol...


ACS Med Chem Lett 7: 1219-1221 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00261
BindingDB Entry DOI: 10.7270/Q2251M51
More data for this
Ligand-Target Pair
N-acetyltransferase Eis


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
BDBM50201757
PNG
(CHEMBL3958709)
Show SMILES COC(=O)c1cc2occc2n1CC(=O)c1ccccc1
Show InChI InChI=1S/C16H13NO4/c1-20-16(19)13-9-15-12(7-8-21-15)17(13)10-14(18)11-5-3-2-4-6-11/h2-9H,10H2,1H3
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n/an/a 3.00E+3n/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis H37Rv Eis expressed in Escherichia coli BL21(DE3) using Acetyl-CoA as substrate preincubated for 10 mins fol...


ACS Med Chem Lett 7: 1219-1221 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00261
BindingDB Entry DOI: 10.7270/Q2251M51
More data for this
Ligand-Target Pair
N-acetyltransferase Eis


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
BDBM50201739
PNG
(CHEMBL3909271)
Show SMILES COC(=O)c1cc2occc2n1CC(=O)c1ccc(C)cc1
Show InChI InChI=1S/C17H15NO4/c1-11-3-5-12(6-4-11)15(19)10-18-13-7-8-22-16(13)9-14(18)17(20)21-2/h3-9H,10H2,1-2H3
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n/an/a 5.80E+3n/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis H37Rv Eis expressed in Escherichia coli BL21(DE3) using Acetyl-CoA as substrate preincubated for 10 mins fol...


ACS Med Chem Lett 7: 1219-1221 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00261
BindingDB Entry DOI: 10.7270/Q2251M51
More data for this
Ligand-Target Pair
N-acetyltransferase Eis


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
BDBM50201752
PNG
(CHEMBL3890216)
Show SMILES Cc1ccc(cc1)C(=O)CN1C(=O)C2(OCCO2)c2ccccc12
Show InChI InChI=1S/C19H17NO4/c1-13-6-8-14(9-7-13)17(21)12-20-16-5-3-2-4-15(16)19(18(20)22)23-10-11-24-19/h2-9H,10-12H2,1H3
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n/an/a 8.70E+3n/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis H37Rv Eis expressed in Escherichia coli BL21(DE3) using Acetyl-CoA as substrate preincubated for 10 mins fol...


ACS Med Chem Lett 7: 1219-1221 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00261
BindingDB Entry DOI: 10.7270/Q2251M51
More data for this
Ligand-Target Pair
N-acetyltransferase Eis


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
BDBM50201762
PNG
(CHEMBL3899105)
Show SMILES Fc1ccccc1C(=O)CN1C(=O)C2(OCCO2)c2ccccc12
Show InChI InChI=1S/C18H14FNO4/c19-14-7-3-1-5-12(14)16(21)11-20-15-8-4-2-6-13(15)18(17(20)22)23-9-10-24-18/h1-8H,9-11H2
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n/an/a 2.30E+4n/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis H37Rv Eis expressed in Escherichia coli BL21(DE3) using Acetyl-CoA as substrate preincubated for 10 mins fol...


ACS Med Chem Lett 7: 1219-1221 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00261
BindingDB Entry DOI: 10.7270/Q2251M51
More data for this
Ligand-Target Pair
N-acetyltransferase Eis


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
BDBM50201764
PNG
(CHEMBL1702313)
Show SMILES CC(C)(C)C(=O)CN1C(=O)C2(OCCO2)c2ccccc12
Show InChI InChI=1S/C16H19NO4/c1-15(2,3)13(18)10-17-12-7-5-4-6-11(12)16(14(17)19)20-8-9-21-16/h4-7H,8-10H2,1-3H3
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University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis H37Rv Eis expressed in Escherichia coli BL21(DE3) using Acetyl-CoA as substrate preincubated for 10 mins fol...


ACS Med Chem Lett 7: 1219-1221 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00261
BindingDB Entry DOI: 10.7270/Q2251M51
More data for this
Ligand-Target Pair
N-acetyltransferase Eis


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
BDBM50201761
PNG
(CHEMBL3900249)
Show SMILES CCC(=O)Cn1c(cc2occc12)C(=O)OC
Show InChI InChI=1S/C12H13NO4/c1-3-8(14)7-13-9-4-5-17-11(9)6-10(13)12(15)16-2/h4-6H,3,7H2,1-2H3
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University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis H37Rv Eis expressed in Escherichia coli BL21(DE3) using Acetyl-CoA as substrate preincubated for 10 mins fol...


ACS Med Chem Lett 7: 1219-1221 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00261
BindingDB Entry DOI: 10.7270/Q2251M51
More data for this
Ligand-Target Pair
N-acetyltransferase Eis


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
BDBM50201758
PNG
(CHEMBL3952477)
Show SMILES O=C(CN1C(=O)C2(OCCO2)c2ccccc12)c1ccc2ccccc2c1
Show InChI InChI=1S/C22H17NO4/c24-20(17-10-9-15-5-1-2-6-16(15)13-17)14-23-19-8-4-3-7-18(19)22(21(23)25)26-11-12-27-22/h1-10,13H,11-12,14H2
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n/an/a>2.00E+5n/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis H37Rv Eis expressed in Escherichia coli BL21(DE3) using Acetyl-CoA as substrate preincubated for 10 mins fol...


ACS Med Chem Lett 7: 1219-1221 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00261
BindingDB Entry DOI: 10.7270/Q2251M51
More data for this
Ligand-Target Pair
N-acetyltransferase Eis


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
BDBM50201754
PNG
(CHEMBL3971387)
Show SMILES COC(=O)c1cc2occc2n1CC(=O)C(C)(C)C
Show InChI InChI=1S/C14H17NO4/c1-14(2,3)12(16)8-15-9-5-6-19-11(9)7-10(15)13(17)18-4/h5-7H,8H2,1-4H3
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n/an/a>2.00E+5n/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis H37Rv Eis expressed in Escherichia coli BL21(DE3) using Acetyl-CoA as substrate preincubated for 10 mins fol...


ACS Med Chem Lett 7: 1219-1221 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00261
BindingDB Entry DOI: 10.7270/Q2251M51
More data for this
Ligand-Target Pair
N-acetyltransferase Eis


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
BDBM50201753
PNG
(CHEMBL3976851)
Show SMILES CCC(=O)CN1C(=O)C2(OCCO2)c2ccccc12
Show InChI InChI=1S/C14H15NO4/c1-2-10(16)9-15-12-6-4-3-5-11(12)14(13(15)17)18-7-8-19-14/h3-6H,2,7-9H2,1H3
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n/an/a>2.00E+5n/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis H37Rv Eis expressed in Escherichia coli BL21(DE3) using Acetyl-CoA as substrate preincubated for 10 mins fol...


ACS Med Chem Lett 7: 1219-1221 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00261
BindingDB Entry DOI: 10.7270/Q2251M51
More data for this
Ligand-Target Pair
N-acetyltransferase Eis


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
BDBM50201751
PNG
(CHEMBL1538832)
Show SMILES Brc1ccc(cc1)C(=O)CN1C(=O)C2(OCCO2)c2ccccc12
Show InChI InChI=1S/C18H14BrNO4/c19-13-7-5-12(6-8-13)16(21)11-20-15-4-2-1-3-14(15)18(17(20)22)23-9-10-24-18/h1-8H,9-11H2
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n/an/a>2.00E+5n/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis H37Rv Eis expressed in Escherichia coli BL21(DE3) using Acetyl-CoA as substrate preincubated for 10 mins fol...


ACS Med Chem Lett 7: 1219-1221 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00261
BindingDB Entry DOI: 10.7270/Q2251M51
More data for this
Ligand-Target Pair
N-acetyltransferase Eis


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
BDBM50201748
PNG
(CHEMBL3964177)
Show SMILES COC(=O)c1cc2occc2n1CC(=O)c1ccc(Br)cc1
Show InChI InChI=1S/C16H12BrNO4/c1-21-16(20)13-8-15-12(6-7-22-15)18(13)9-14(19)10-2-4-11(17)5-3-10/h2-8H,9H2,1H3
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PubMed
n/an/a>2.00E+5n/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis H37Rv Eis expressed in Escherichia coli BL21(DE3) using Acetyl-CoA as substrate preincubated for 10 mins fol...


ACS Med Chem Lett 7: 1219-1221 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00261
BindingDB Entry DOI: 10.7270/Q2251M51
More data for this
Ligand-Target Pair
N-acetyltransferase Eis


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
BDBM50201744
PNG
(CHEMBL3891229)
Show SMILES COC(=O)c1cc2occc2n1CC(=O)c1cccc(OC)c1
Show InChI InChI=1S/C17H15NO5/c1-21-12-5-3-4-11(8-12)15(19)10-18-13-6-7-23-16(13)9-14(18)17(20)22-2/h3-9H,10H2,1-2H3
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n/an/a>2.00E+5n/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis H37Rv Eis expressed in Escherichia coli BL21(DE3) using Acetyl-CoA as substrate preincubated for 10 mins fol...


ACS Med Chem Lett 7: 1219-1221 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00261
BindingDB Entry DOI: 10.7270/Q2251M51
More data for this
Ligand-Target Pair
N-acetyltransferase Eis


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
BDBM50201743
PNG
(CHEMBL3979506)
Show SMILES COC(=O)c1cc2occc2n1CC(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C20H15NO4/c1-24-20(23)17-11-19-16(8-9-25-19)21(17)12-18(22)15-7-6-13-4-2-3-5-14(13)10-15/h2-11H,12H2,1H3
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PubMed
n/an/a>2.00E+5n/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis H37Rv Eis expressed in Escherichia coli BL21(DE3) using Acetyl-CoA as substrate preincubated for 10 mins fol...


ACS Med Chem Lett 7: 1219-1221 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00261
BindingDB Entry DOI: 10.7270/Q2251M51
More data for this
Ligand-Target Pair
N-acetyltransferase Eis


(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
BDBM50201740
PNG
(CHEMBL3940094)
Show SMILES COc1cccc(c1)C(=O)CN1C(=O)C2(OCCO2)c2ccccc12
Show InChI InChI=1S/C19H17NO5/c1-23-14-6-4-5-13(11-14)17(21)12-20-16-8-3-2-7-15(16)19(18(20)22)24-9-10-25-19/h2-8,11H,9-10,12H2,1H3
PDB

GoogleScholar
AffyNet 
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UniChem

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



University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis H37Rv Eis expressed in Escherichia coli BL21(DE3) using Acetyl-CoA as substrate preincubated for 10 mins fol...


ACS Med Chem Lett 7: 1219-1221 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00261
BindingDB Entry DOI: 10.7270/Q2251M51
More data for this
Ligand-Target Pair