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Compile Data Set for Download or QSAR

Found 157 hits Enz. Inhib. hit(s) with Target = 'RNA polymerase beta subunit (EC 2.7.7.6)'   
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
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM41193
PNG
(1-(2-Chloro-benzyl)-8-hydroxy-6-methyl-1H-[1,2,4]t...)
Show SMILES Cc1cc(O)c2[n+](Cc3ccccc3Cl)ncn2n1
Show InChI InChI=1S/C13H11ClN4O/c1-9-6-12(19)13-17(15-8-18(13)16-9)7-10-4-2-3-5-11(10)14/h2-6,8H,7H2,1H3/p+1
PDB
MMDB

UniProtKB/TrEMBL

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n/an/a 6.42E+3n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


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Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...


Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM41200
PNG
(1-(4-Chloro-benzyl)-8-hydroxy-6-methyl-1H-[1,2,4]t...)
Show SMILES Cc1cc(O)c2[n+](Cc3ccc(Cl)cc3)ncn2n1
Show InChI InChI=1S/C13H11ClN4O/c1-9-6-12(19)13-17(15-8-18(13)16-9)7-10-2-4-11(14)5-3-10/h2-6,8H,7H2,1H3/p+1
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n/an/a 8.38E+3n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


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Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...


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More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM34233
PNG
(2-Phenyl-benzo[d]isoselenazol-3-one | 2-Phenyl-ben...)
Show SMILES O=c1n([se]c2ccccc12)-c1ccccc1
Show InChI InChI=1S/C13H9NOSe/c15-13-11-8-4-5-9-12(11)16-14(13)10-6-2-1-3-7-10/h1-9H
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n/an/a 1.17E+4n/an/an/an/an/an/a



PCMD

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More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM32020
PNG
(4-[4-(3,4-dihydroxyphenyl)-2,3-dimethyl-butyl]pyro...)
Show SMILES CC(Cc1ccc(O)c(O)c1)C(C)Cc1ccc(O)c(O)c1
Show InChI InChI=1S/C18H22O4/c1-11(7-13-3-5-15(19)17(21)9-13)12(2)8-14-4-6-16(20)18(22)10-14/h3-6,9-12,19-22H,7-8H2,1-2H3
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n/an/a 1.24E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


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More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM41228
PNG
(2,3,5,6-tetrakis(2-furanyl)pyrazine | 2,3,5,6-tetr...)
Show SMILES c1coc(c1)-c1nc(-c2ccco2)c(nc1-c1ccco1)-c1ccco1
Show InChI InChI=1S/C20H12N2O4/c1-5-13(23-9-1)17-18(14-6-2-10-24-14)22-20(16-8-4-12-26-16)19(21-17)15-7-3-11-25-15/h1-12H
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n/an/a 1.26E+4n/an/an/an/an/an/a



PCMD

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Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM43341
PNG
((Z,3R)-4-formyl-3-(2-ketoethyl)hex-4-enoic acid 2-...)
Show SMILES C\C=C(/C=O)[C@H](CC=O)CC(=O)OCCc1ccc(O)cc1
Show InChI InChI=1S/C17H20O5/c1-2-14(12-19)15(7-9-18)11-17(21)22-10-8-13-3-5-16(20)6-4-13/h2-6,9,12,15,20H,7-8,10-11H2,1H3/b14-2+/t15-/m1/s1
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n/an/a 1.29E+4n/an/an/an/an/an/a



PCMD

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More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM32022
PNG
((7S,9S)-7-[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methy...)
Show SMILES COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@H](N)[C@H](O)[C@H](C)O5)c4c(O)c3C(=O)c12)C(=O)CO
Show InChI InChI=1S/C27H29NO11/c1-10-22(31)13(28)6-17(38-10)39-15-8-27(36,16(30)9-29)7-12-19(15)26(35)21-20(24(12)33)23(32)11-4-3-5-14(37-2)18(11)25(21)34/h3-5,10,13,15,17,22,29,31,33,35-36H,6-9,28H2,1-2H3/t10-,13-,15-,17-,22+,27-/m0/s1
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n/an/a 1.44E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


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Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM41255
PNG
(2,5-dimethoxy-N-(4-oxidanylnaphthalen-1-yl)benzene...)
Show SMILES COc1ccc(OC)c(c1)S(=O)(=O)Nc1ccc(O)c2ccccc12
Show InChI InChI=1S/C18H17NO5S/c1-23-12-7-10-17(24-2)18(11-12)25(21,22)19-15-8-9-16(20)14-6-4-3-5-13(14)15/h3-11,19-20H,1-2H3
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n/an/a 1.53E+4n/an/an/an/an/an/a



PCMD

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Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM43311
PNG
(3,4-dimethoxy-N-(4-oxidanylnaphthalen-1-yl)benzene...)
Show SMILES COc1ccc(cc1OC)S(=O)(=O)Nc1ccc(O)c2ccccc12
Show InChI InChI=1S/C18H17NO5S/c1-23-17-10-7-12(11-18(17)24-2)25(21,22)19-15-8-9-16(20)14-6-4-3-5-13(14)15/h3-11,19-20H,1-2H3
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n/an/a 1.54E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


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Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...


Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM43306
PNG
(4-fluoranyl-N-(4-oxidanylnaphthalen-1-yl)benzenesu...)
Show SMILES Oc1ccc(NS(=O)(=O)c2ccc(F)cc2)c2ccccc12
Show InChI InChI=1S/C16H12FNO3S/c17-11-5-7-12(8-6-11)22(20,21)18-15-9-10-16(19)14-4-2-1-3-13(14)15/h1-10,18-19H
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n/an/a 1.73E+4n/an/an/an/an/an/a



PCMD

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Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM41221
PNG
(2-amino-4-butan-2-ylphenol | 2-amino-4-sec-butyl-p...)
Show SMILES CCC(C)c1ccc(O)c(N)c1
Show InChI InChI=1S/C10H15NO/c1-3-7(2)8-4-5-10(12)9(11)6-8/h4-7,12H,3,11H2,1-2H3
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n/an/a 1.76E+4n/an/an/an/an/an/a



PCMD

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Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM43334
PNG
(3,4-dimethoxy-N-(2-oxidanylnaphthalen-1-yl)benzene...)
Show SMILES COc1ccc(cc1OC)S(=O)(=O)Nc1c(O)ccc2ccccc12
Show InChI InChI=1S/C18H17NO5S/c1-23-16-10-8-13(11-17(16)24-2)25(21,22)19-18-14-6-4-3-5-12(14)7-9-15(18)20/h3-11,19-20H,1-2H3
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n/an/a 1.79E+4n/an/an/an/an/an/a



PCMD

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Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM41255
PNG
(2,5-dimethoxy-N-(4-oxidanylnaphthalen-1-yl)benzene...)
Show SMILES COc1ccc(OC)c(c1)S(=O)(=O)Nc1ccc(O)c2ccccc12
Show InChI InChI=1S/C18H17NO5S/c1-23-12-7-10-17(24-2)18(11-12)25(21,22)19-15-8-9-16(20)14-6-4-3-5-13(14)15/h3-11,19-20H,1-2H3
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n/an/a 1.82E+4n/an/an/an/an/an/a



PCMD

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More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM34621
PNG
(1-cyclohexyl-3-[5-fluoranyl-4-oxidanylidene-5-(tri...)
Show SMILES FC(F)(F)C1(F)SC(NC(=O)NC2CCCCC2)=NC1=O
Show InChI InChI=1S/C11H13F4N3O2S/c12-10(11(13,14)15)7(19)17-9(21-10)18-8(20)16-6-4-2-1-3-5-6/h6H,1-5H2,(H2,16,17,18,19,20)
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n/an/a 1.84E+4n/an/an/an/an/an/a



PCMD

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More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM43304
PNG
(4-methoxy-N-(2-oxidanylnaphthalen-1-yl)benzenesulf...)
Show SMILES COc1ccc(cc1)S(=O)(=O)Nc1c(O)ccc2ccccc12
Show InChI InChI=1S/C17H15NO4S/c1-22-13-7-9-14(10-8-13)23(20,21)18-17-15-5-3-2-4-12(15)6-11-16(17)19/h2-11,18-19H,1H3
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n/an/a 1.93E+4n/an/an/an/an/an/a



PCMD

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Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM43294
PNG
(2,5-dimethoxy-N-(2-oxidanylnaphthalen-1-yl)benzene...)
Show SMILES COc1ccc(OC)c(c1)S(=O)(=O)Nc1c(O)ccc2ccccc12
Show InChI InChI=1S/C18H17NO5S/c1-23-13-8-10-16(24-2)17(11-13)25(21,22)19-18-14-6-4-3-5-12(14)7-9-15(18)20/h3-11,19-20H,1-2H3
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n/an/a 1.94E+4n/an/an/an/an/an/a



PCMD

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More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM43305
PNG
(N-(4-hydroxy-1-naphthalenyl)benzenesulfonamide | N...)
Show SMILES Oc1ccc(NS(=O)(=O)c2ccccc2)c2ccccc12
Show InChI InChI=1S/C16H13NO3S/c18-16-11-10-15(13-8-4-5-9-14(13)16)17-21(19,20)12-6-2-1-3-7-12/h1-11,17-18H
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n/an/a 2.01E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


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Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...


Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM43336
PNG
(4-methyl-N-(2-oxidanylnaphthalen-1-yl)benzenesulfo...)
Show SMILES Cc1ccc(cc1)S(=O)(=O)Nc1c(O)ccc2ccccc12
Show InChI InChI=1S/C17H15NO3S/c1-12-6-9-14(10-7-12)22(20,21)18-17-15-5-3-2-4-13(15)8-11-16(17)19/h2-11,18-19H,1H3
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n/an/a 2.29E+4n/an/an/an/an/an/a



PCMD

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Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...


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More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM41233
PNG
(1-(4-methyl-1,3-thiazol-2-yl)-3-[2-(trifluoromethy...)
Show SMILES Cc1csc(NC(=O)NC2(Oc3ccccc3O2)C(F)(F)F)n1
Show InChI InChI=1S/C13H10F3N3O3S/c1-7-6-23-11(17-7)18-10(20)19-13(12(14,15)16)21-8-4-2-3-5-9(8)22-13/h2-6H,1H3,(H2,17,18,19,20)
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n/an/a 2.30E+4n/an/an/an/an/an/a



PCMD

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More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM32017
PNG
((7S,9S)-7-[(2R,4S,5S,6S)-4-azanyl-6-methyl-5-oxida...)
Show SMILES COc1cccc2C(=O)c3c(O)c4C[C@](O)(C[C@H](O[C@H]5C[C@H](N)[C@H](O)[C@H](C)O5)c4c(O)c3C(=O)c12)C(C)=O
Show InChI InChI=1S/C27H29NO10/c1-10-22(30)14(28)7-17(37-10)38-16-9-27(35,11(2)29)8-13-19(16)26(34)21-20(24(13)32)23(31)12-5-4-6-15(36-3)18(12)25(21)33/h4-6,10,14,16-17,22,30,32,34-35H,7-9,28H2,1-3H3/t10-,14-,16-,17-,22+,27-/m0/s1
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n/an/a 2.32E+4n/an/an/an/an/an/a



PCMD

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More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM4375
PNG
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)
Show SMILES OC(=O)\C=C\c1ccc(O)c(O)c1
Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+
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n/an/a 2.38E+4n/an/an/an/an/an/a



PCMD

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Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM34599
PNG
(1-[5-chloranyl-2-(trifluoromethyl)-1,3-benzodioxol...)
Show SMILES FC(F)(F)C1(NC(=O)Nc2cc(ncn2)N2CCOCC2)Oc2ccc(Cl)cc2O1
Show InChI InChI=1S/C17H15ClF3N5O4/c18-10-1-2-11-12(7-10)30-17(29-11,16(19,20)21)25-15(27)24-13-8-14(23-9-22-13)26-3-5-28-6-4-26/h1-2,7-9H,3-6H2,(H2,22,23,24,25,27)
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n/an/a 2.63E+4n/an/an/an/an/an/a



PCMD

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Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM32063
PNG
(MLS000055599 | N-[2-[(5-chloro-2-pyridinyl)amino]-...)
Show SMILES CCOC(=O)NC1(Nc2ccc(Cl)cn2)Oc2ccccc2O1
Show InChI InChI=1S/C15H14ClN3O4/c1-2-21-14(20)19-15(18-13-8-7-10(16)9-17-13)22-11-5-3-4-6-12(11)23-15/h3-9H,2H2,1H3,(H,17,18)(H,19,20)
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More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM43307
PNG
(4-methyl-N-(4-oxidanylnaphthalen-1-yl)benzenesulfo...)
Show SMILES Cc1ccc(cc1)S(=O)(=O)Nc1ccc(O)c2ccccc12
Show InChI InChI=1S/C17H15NO3S/c1-12-6-8-13(9-7-12)22(20,21)18-16-10-11-17(19)15-5-3-2-4-14(15)16/h2-11,18-19H,1H3
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n/an/a 2.84E+4n/an/an/an/an/an/a



PCMD

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More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM43335
PNG
(N-(2-hydroxy-1-naphthalenyl)benzenesulfonamide | N...)
Show SMILES Oc1ccc2ccccc2c1NS(=O)(=O)c1ccccc1
Show InChI InChI=1S/C16H13NO3S/c18-15-11-10-12-6-4-5-9-14(12)16(15)17-21(19,20)13-7-2-1-3-8-13/h1-11,17-18H
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n/an/a 2.89E+4n/an/an/an/an/an/a



PCMD

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Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...


Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM43333
PNG
(4-fluoranyl-N-(2-oxidanylnaphthalen-1-yl)benzenesu...)
Show SMILES Oc1ccc2ccccc2c1NS(=O)(=O)c1ccc(F)cc1
Show InChI InChI=1S/C16H12FNO3S/c17-12-6-8-13(9-7-12)22(20,21)18-16-14-4-2-1-3-11(14)5-10-15(16)19/h1-10,18-19H
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n/an/a 2.95E+4n/an/an/an/an/an/a



PCMD

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Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM41272
PNG
(MLS000111516 | N-(5-chloranyl-2,3-dimethyl-4-oxida...)
Show SMILES Cc1c(C)c(NS(=O)(=O)c2ccccc2)cc(Cl)c1O
Show InChI InChI=1S/C14H14ClNO3S/c1-9-10(2)14(17)12(15)8-13(9)16-20(18,19)11-6-4-3-5-7-11/h3-8,16-17H,1-2H3
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n/an/a 3.14E+4n/an/an/an/an/an/a



PCMD

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Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM43320
PNG
(3,4-dimethoxy-N-(2-oxidanylnaphthalen-1-yl)benzami...)
Show SMILES COc1ccc(cc1OC)C(=O)Nc1c(O)ccc2ccccc12
Show InChI InChI=1S/C19H17NO4/c1-23-16-10-8-13(11-17(16)24-2)19(22)20-18-14-6-4-3-5-12(14)7-9-15(18)21/h3-11,21H,1-2H3,(H,20,22)
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n/an/a 3.31E+4n/an/an/an/an/an/a



PCMD

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More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM32099
PNG
(MLS000044274 | N-[5-chloranyl-2-(trifluoromethyl)-...)
Show SMILES FC(F)(F)C1(NC(=O)N2CCC3(CC2)OCCO3)Oc2ccc(Cl)cc2O1
Show InChI InChI=1S/C16H16ClF3N2O5/c17-10-1-2-11-12(9-10)27-16(26-11,15(18,19)20)21-13(23)22-5-3-14(4-6-22)24-7-8-25-14/h1-2,9H,3-8H2,(H,21,23)
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n/an/a 3.58E+4n/an/an/an/an/an/a



PCMD

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Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM43339
PNG
(4-amino-1-naphthalenol;hydrochloride | 4-amino-1-n...)
Show SMILES Nc1ccc(O)c2ccccc12
Show InChI InChI=1S/C10H9NO/c11-9-5-6-10(12)8-4-2-1-3-7(8)9/h1-6,12H,11H2
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n/an/a 3.75E+4n/an/an/an/an/an/a



PCMD

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Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM34412
PNG
(4-methoxy-N-(4-oxidanylnaphthalen-1-yl)benzenesulf...)
Show SMILES COc1ccc(cc1)S(=O)(=O)Nc1ccc(O)c2ccccc12
Show InChI InChI=1S/C17H15NO4S/c1-22-12-6-8-13(9-7-12)23(20,21)18-16-10-11-17(19)15-5-3-2-4-14(15)16/h2-11,18-19H,1H3
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n/an/a 3.94E+4n/an/an/an/an/an/a



PCMD

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Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM43308
PNG
(N-(4-hydroxy-1-naphthalenyl)-1-naphthalenesulfonam...)
Show SMILES Oc1ccc(NS(=O)(=O)c2cccc3ccccc23)c2ccccc12
Show InChI InChI=1S/C20H15NO3S/c22-19-13-12-18(16-9-3-4-10-17(16)19)21-25(23,24)20-11-5-7-14-6-1-2-8-15(14)20/h1-13,21-22H
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n/an/a 4.14E+4n/an/an/an/an/an/a



PCMD

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Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM41270
PNG
(MLS000111394 | N-(3-chloranyl-2,5-dimethyl-4-oxida...)
Show SMILES Cc1cc(NS(=O)(=O)c2ccccc2)c(C)c(Cl)c1O
Show InChI InChI=1S/C14H14ClNO3S/c1-9-8-12(10(2)13(15)14(9)17)16-20(18,19)11-6-4-3-5-7-11/h3-8,16-17H,1-2H3
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n/an/a 4.38E+4n/an/an/an/an/an/a



PCMD

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Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM41191
PNG
(MLS000029450 | N-(3-Cyano-5,6,7,8-tetrahydro-4H-cy...)
Show SMILES CC(=O)Nc1sc2CCCCCc2c1C#N
Show InChI InChI=1S/C12H14N2OS/c1-8(15)14-12-10(7-13)9-5-3-2-4-6-11(9)16-12/h2-6H2,1H3,(H,14,15)
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n/an/a>5.00E+4n/an/an/an/an/an/a



PCMD

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Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...


Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM41192
PNG
(2-[[5-[(4-chloroanilino)methyl]-1,3,4-oxadiazol-2-...)
Show SMILES Clc1ccc(NCc2nnc(SCC(=O)Nc3nc4CCCCc4s3)o2)cc1
Show InChI InChI=1S/C18H18ClN5O2S2/c19-11-5-7-12(8-6-11)20-9-16-23-24-18(26-16)27-10-15(25)22-17-21-13-3-1-2-4-14(13)28-17/h5-8,20H,1-4,9-10H2,(H,21,22,25)
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PCMD

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Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM40570
PNG
(2-(2-furanyl)-2,3-dihydro-1H-perimidine | 2-(2-fur...)
Show SMILES N1C(Nc2cccc3cccc1c23)c1ccco1
Show InChI InChI=1S/C15H12N2O/c1-4-10-5-2-7-12-14(10)11(6-1)16-15(17-12)13-8-3-9-18-13/h1-9,15-17H
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PCMD

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Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM41194
PNG
((1-Methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-naphth...)
Show SMILES Cn1ncc2c(Nc3ccc4ccccc4c3)ncnc12
Show InChI InChI=1S/C16H13N5/c1-21-16-14(9-19-21)15(17-10-18-16)20-13-7-6-11-4-2-3-5-12(11)8-13/h2-10H,1H3,(H,17,18,20)
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PCMD

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Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM41195
PNG
(2-piperidin-1-ylethyl 3-methyl-1-benzofuran-2-carb...)
Show SMILES Cc1c(oc2ccccc12)C(=O)OCCN1CCCCC1
Show InChI InChI=1S/C17H21NO3/c1-13-14-7-3-4-8-15(14)21-16(13)17(19)20-12-11-18-9-5-2-6-10-18/h3-4,7-8H,2,5-6,9-12H2,1H3
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PCMD

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Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM41196
PNG
(2-[[2-(4-butoxyanilino)-2-keto-ethyl]thio]acetic a...)
Show SMILES CCCCOc1ccc(NC(=O)CSCC(=O)OCC)cc1
Show InChI InChI=1S/C16H23NO4S/c1-3-5-10-21-14-8-6-13(7-9-14)17-15(18)11-22-12-16(19)20-4-2/h6-9H,3-5,10-12H2,1-2H3,(H,17,18)
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PCMD

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Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM41197
PNG
(Cyclopropanecarboxylic acid (2-{2-[(4-ethoxy-pheny...)
Show SMILES CCOc1ccc(NC(=O)Cn2nnc(n2)-c2ccccc2NC(=O)C2CC2)cc1
Show InChI InChI=1S/C21H22N6O3/c1-2-30-16-11-9-15(10-12-16)22-19(28)13-27-25-20(24-26-27)17-5-3-4-6-18(17)23-21(29)14-7-8-14/h3-6,9-12,14H,2,7-8,13H2,1H3,(H,22,28)(H,23,29)
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PCMD

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Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM41198
PNG
(2-[[5-[(4-fluoroanilino)methyl]-4-(4-methylphenyl)...)
Show SMILES Cc1ccc(cc1)-n1c(CNc2ccc(F)cc2)nnc1SCC(=O)N1CCCC1
Show InChI InChI=1S/C22H24FN5OS/c1-16-4-10-19(11-5-16)28-20(14-24-18-8-6-17(23)7-9-18)25-26-22(28)30-15-21(29)27-12-2-3-13-27/h4-11,24H,2-3,12-15H2,1H3
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PCMD

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Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM41199
PNG
(2-(3,4-dimethoxyphenyl)-3-ethanoyl-1-(2-methoxyeth...)
Show SMILES COCCN1C(C(C(C)=O)C(=O)C1=O)c1ccc(OC)c(OC)c1
Show InChI InChI=1S/C17H21NO6/c1-10(19)14-15(18(7-8-22-2)17(21)16(14)20)11-5-6-12(23-3)13(9-11)24-4/h5-6,9,14-15H,7-8H2,1-4H3
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Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM41201
PNG
(2-[5-[(4-Ethoxy-phenylamino)-methyl]-4-(4-methoxy-...)
Show SMILES CCOc1ccc(NCc2nnc(SCC(=O)Nc3cc(C)on3)n2-c2ccc(OC)cc2)cc1
Show InChI InChI=1S/C24H26N6O4S/c1-4-33-20-9-5-17(6-10-20)25-14-22-27-28-24(30(22)18-7-11-19(32-3)12-8-18)35-15-23(31)26-21-13-16(2)34-29-21/h5-13,25H,4,14-15H2,1-3H3,(H,26,29,31)
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Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM41202
PNG
(MLS000030899 | N-(2-furanylmethyl)-2-[[4-(4-methox...)
Show SMILES COc1ccc(cc1)-n1c(COc2cccc(C)c2)nnc1SCC(=O)NCc1ccco1
Show InChI InChI=1S/C24H24N4O4S/c1-17-5-3-6-20(13-17)32-15-22-26-27-24(28(22)18-8-10-19(30-2)11-9-18)33-16-23(29)25-14-21-7-4-12-31-21/h3-13H,14-16H2,1-2H3,(H,25,29)
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Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM41203
PNG
(2-(1,3-Dimethyl-2,6-dioxo-7-propyl-2,3,6,7-tetrahy...)
Show SMILES CCCn1c(SCC(=O)Nc2nc3CCCCc3s2)nc2n(C)c(=O)n(C)c(=O)c12
Show InChI InChI=1S/C19H24N6O3S2/c1-4-9-25-14-15(23(2)19(28)24(3)16(14)27)22-18(25)29-10-13(26)21-17-20-11-7-5-6-8-12(11)30-17/h4-10H2,1-3H3,(H,20,21,26)
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Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM41204
PNG
(2-(7-Butyl-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahyd...)
Show SMILES CCCCn1c(SCC(=O)Nc2nnc(C)s2)nc2n(C)c(=O)n(C)c(=O)c12
Show InChI InChI=1S/C16H21N7O3S2/c1-5-6-7-23-11-12(21(3)16(26)22(4)13(11)25)18-15(23)27-8-10(24)17-14-20-19-9(2)28-14/h5-8H2,1-4H3,(H,17,20,24)
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More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM50318688
PNG
(3-N-Morpholinocarbamate-4-morpholino-1,2,5-thiadia...)
Show SMILES O=C(Oc1nsnc1N1CCOCC1)N1CCOCC1
Show InChI InChI=1S/C11H16N4O4S/c16-11(15-3-7-18-8-4-15)19-10-9(12-20-13-10)14-1-5-17-6-2-14/h1-8H2
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n/an/a>5.00E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...


Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM41205
PNG
(3,6-bis(2-pyridinyl)-1,2,4,5-tetrazine | 3,6-bis(2...)
Show SMILES c1ccc(nc1)-c1nnc(nn1)-c1ccccn1
Show InChI InChI=1S/C12H8N6/c1-3-7-13-9(5-1)11-15-17-12(18-16-11)10-6-2-4-8-14-10/h1-8H
PDB
MMDB

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PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...


Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM41206
PNG
(2-ethoxy-2,2-diphenyl-acetic acid [3-(diethylamino...)
Show SMILES CCOC(C(=O)OCC(O)CN(CC)CC)(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C23H31NO4/c1-4-24(5-2)17-21(25)18-27-22(26)23(28-6-3,19-13-9-7-10-14-19)20-15-11-8-12-16-20/h7-16,21,25H,4-6,17-18H2,1-3H3
PDB
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PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...


Citation and Details
More data for this
Ligand-Target Pair
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM41207
PNG
(MLS000079915 | N-(1H-benzimidazol-2-ylmethyl)-2-fu...)
Show SMILES O=C(NCc1nc2ccccc2[nH]1)c1ccco1
Show InChI InChI=1S/C13H11N3O2/c17-13(11-6-3-7-18-11)14-8-12-15-9-4-1-2-5-10(9)16-12/h1-7H,8H2,(H,14,17)(H,15,16)
PDB
MMDB

UniProtKB/TrEMBL

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PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...


Citation and Details
More data for this
Ligand-Target Pair
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