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Compile Data Set for Download or QSAR

Found 1000 hits Enz. Inhib. hit(s) with all data for entry = 4121   
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
Transcription factor p65


(Homo sapiens (Human))		BDBM49168
PNG
(MLS000031461 | N-[2-(2-Bromo-phenyl)-benzooxazol-5...)
Show SMILES CC(=O)Nc1ccc2oc(nc2c1)-c1ccccc1Br
Show InChI InChI=1S/C15H11BrN2O2/c1-9(19)17-10-6-7-14-13(8-10)18-15(20-14)11-4-2-3-5-12(11)16/h2-8H,1H3,(H,17,19)
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n/an/an/an/a 1.06E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49169
PNG
((6Z)-6-[5-(3-fluorophenyl)-1,2-dihydropyrazol-3-yl...)
Show SMILES Oc1ccccc1-c1cc([nH]n1)-c1cccc(F)c1
Show InChI InChI=1S/C15H11FN2O/c16-11-5-3-4-10(8-11)13-9-14(18-17-13)12-6-1-2-7-15(12)19/h1-9,19H,(H,17,18)
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n/an/an/an/a 7.73E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49170
PNG
(MLS000029143 | N-(5-Chloro-pyridin-2-yl)-4-methyl-...)
Show SMILES Cc1ccc(cc1)C(=O)Nc1ccc(Cl)cn1
Show InChI InChI=1S/C13H11ClN2O/c1-9-2-4-10(5-3-9)13(17)16-12-7-6-11(14)8-15-12/h2-8H,1H3,(H,15,16,17)
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n/an/an/an/a 1.73E+4n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM39891
PNG
(Furan-2-carboxylic acid quinolin-3-ylamide | MLS00...)
Show SMILES O=C(Nc1cnc2ccccc2c1)c1ccco1
Show InChI InChI=1S/C14H10N2O2/c17-14(13-6-3-7-18-13)16-11-8-10-4-1-2-5-12(10)15-9-11/h1-9H,(H,16,17)
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n/an/an/an/a 1.39E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM40327
PNG
(Cyclopropanecarboxylic acid [2-cyclopropyl-3-(4-me...)
Show SMILES COc1ccc(Cn2c(nc3ccc(NC(=O)C4CC4)cc3c2=O)C2CC2)cc1
Show InChI InChI=1S/C23H23N3O3/c1-29-18-9-2-14(3-10-18)13-26-21(15-4-5-15)25-20-11-8-17(12-19(20)23(26)28)24-22(27)16-6-7-16/h2-3,8-12,15-16H,4-7,13H2,1H3,(H,24,27)
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n/an/an/an/a 1.30E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM50262664
PNG
(CHEMBL504598 | N-(5-benzylthiazol-2-yl)thiophene-2...)
Show SMILES O=C(Nc1ncc(Cc2ccccc2)s1)c1cccs1
Show InChI InChI=1S/C15H12N2OS2/c18-14(13-7-4-8-19-13)17-15-16-10-12(20-15)9-11-5-2-1-3-6-11/h1-8,10H,9H2,(H,16,17,18)
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n/an/an/an/a 1.08E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49171
PNG
(MLS000071959 | N-(4,5,6,7-tetrahydro-1,3-benzothia...)
Show SMILES O=C(Nc1nc2CCCCc2s1)c1cccs1
Show InChI InChI=1S/C12H12N2OS2/c15-11(10-6-3-7-16-10)14-12-13-8-4-1-2-5-9(8)17-12/h3,6-7H,1-2,4-5H2,(H,13,14,15)
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n/an/an/an/a 1.08E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM39421
PNG
(5-Methyl-furan-2-carboxylic acid [5-(4-fluoro-benz...)
Show SMILES Cc1ccc(o1)C(=O)Nc1ncc(Cc2ccc(F)cc2)s1
Show InChI InChI=1S/C16H13FN2O2S/c1-10-2-7-14(21-10)15(20)19-16-18-9-13(22-16)8-11-3-5-12(17)6-4-11/h2-7,9H,8H2,1H3,(H,18,19,20)
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n/an/an/an/a 6.16E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49172
PNG
(6-(4-Chloro-phenyl)-2-methyl-imidazo[2,1-b][1,3,4]...)
Show SMILES Cc1nn2cc(nc2s1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C11H8ClN3S/c1-7-14-15-6-10(13-11(15)16-7)8-2-4-9(12)5-3-8/h2-6H,1H3
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n/an/an/an/a 1.37E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49173
PNG
((4-aminoquinazolin-2-yl)-phenyl-amine;hydrochlorid...)
Show SMILES Nc1nc(Nc2ccccc2)nc2ccccc12
Show InChI InChI=1S/C14H12N4/c15-13-11-8-4-5-9-12(11)17-14(18-13)16-10-6-2-1-3-7-10/h1-9H,(H3,15,16,17,18)
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n/an/an/an/a 1.38E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49174
PNG
(5-Ethoxy-2-phenyl-1H-benzoimidazole | 6-ethoxy-2-p...)
Show SMILES CCOc1ccc2nc([nH]c2c1)-c1ccccc1
Show InChI InChI=1S/C15H14N2O/c1-2-18-12-8-9-13-14(10-12)17-15(16-13)11-6-4-3-5-7-11/h3-10H,2H2,1H3,(H,16,17)
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n/an/an/an/a 1.14E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49175
PNG
(3-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-6-phenyl-p...)
Show SMILES COc1ccccc1N1CCN(CC1)c1ccc(nn1)-c1ccccc1
Show InChI InChI=1S/C21H22N4O/c1-26-20-10-6-5-9-19(20)24-13-15-25(16-14-24)21-12-11-18(22-23-21)17-7-3-2-4-8-17/h2-12H,13-16H2,1H3
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n/an/an/an/a 718n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49176
PNG
((2E)-2-(3-methyl-1,3-benzothiazol-2-ylidene)-1-(2-...)
Show SMILES CN1\C(Sc2ccccc12)=C/C(=O)c1cccs1
Show InChI InChI=1S/C14H11NOS2/c1-15-10-5-2-3-6-12(10)18-14(15)9-11(16)13-7-4-8-17-13/h2-9H,1H3/b14-9+
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n/an/an/an/a 1.28E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM39426
PNG
(7-amino-3-phenyl-6-pyrazolo[1,5-a]pyrimidinecarbox...)
Show SMILES CCOC(=O)c1cnc2c(cnn2c1N)-c1ccccc1
Show InChI InChI=1S/C15H14N4O2/c1-2-21-15(20)12-8-17-14-11(9-18-19(14)13(12)16)10-6-4-3-5-7-10/h3-9H,2,16H2,1H3
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n/an/an/an/a 5.18E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49177
PNG
(2-pyridyl-[4-(2-thienyl)thiazol-2-yl]amine | MLS00...)
Show SMILES N(c1nc(cs1)-c1cccs1)c1ccccn1
Show InChI InChI=1S/C12H9N3S2/c1-2-6-13-11(5-1)15-12-14-9(8-17-12)10-4-3-7-16-10/h1-8H,(H,13,14,15)
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n/an/an/an/a 667n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49178
PNG
((3-Cyano-7-methyl-quinolin-2-ylsulfanyl)-acetic ac...)
Show SMILES CCOC(=O)CSc1nc2cc(C)ccc2cc1C#N
Show InChI InChI=1S/C15H14N2O2S/c1-3-19-14(18)9-20-15-12(8-16)7-11-5-4-10(2)6-13(11)17-15/h4-7H,3,9H2,1-2H3
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n/an/an/an/a 1.10E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM50247460
PNG
(4-(methyl(4-phenylthiazol-2-yl)amino)phenol | CHEM...)
Show SMILES CN(c1nc(cs1)-c1ccccc1)c1ccc(O)cc1
Show InChI InChI=1S/C16H14N2OS/c1-18(13-7-9-14(19)10-8-13)16-17-15(11-20-16)12-5-3-2-4-6-12/h2-11,19H,1H3
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n/an/an/an/a 1.02E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM38855
PNG
(2-(2-furanyl)-3-methylbenzo[f]benzimidazole | 2-(2...)
Show SMILES Cn1c(nc2cc3ccccc3cc12)-c1ccco1
Show InChI InChI=1S/C16H12N2O/c1-18-14-10-12-6-3-2-5-11(12)9-13(14)17-16(18)15-7-4-8-19-15/h2-10H,1H3
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n/an/an/an/a 816n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM50131053
PNG
(10-Methoxy-8,13-dihydro-7H-indolo[2',3':3,4]pyrido...)
Show SMILES COc1ccc2[nH]c-3c(CCn4c-3nc3ccccc3c4=O)c2c1
Show InChI InChI=1S/C19H15N3O2/c1-24-11-6-7-16-14(10-11)12-8-9-22-18(17(12)20-16)21-15-5-3-2-4-13(15)19(22)23/h2-7,10,20H,8-9H2,1H3
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n/an/an/an/a 185n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49179
PNG
((3-Cyano-7-methoxy-quinolin-2-ylsulfanyl)-acetic a...)
Show SMILES CCOC(=O)CSc1nc2cc(OC)ccc2cc1C#N
Show InChI InChI=1S/C15H14N2O3S/c1-3-20-14(18)9-21-15-11(8-16)6-10-4-5-12(19-2)7-13(10)17-15/h4-7H,3,9H2,1-2H3
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n/an/an/an/a 144n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49180
PNG
(4-(6-Methyl-benzooxazol-2-yl)-benzoic acid methyl ...)
Show SMILES COC(=O)c1ccc(cc1)-c1nc2ccc(C)cc2o1
Show InChI InChI=1S/C16H13NO3/c1-10-3-8-13-14(9-10)20-15(17-13)11-4-6-12(7-5-11)16(18)19-2/h3-9H,1-2H3
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n/an/an/an/a 3.30E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM42891
PNG
((7-Cyano-[1,3]dioxolo[4,5-g]quinolin-6-ylsulfanyl)...)
Show SMILES COC(=O)CSc1nc2cc3OCOc3cc2cc1C#N
Show InChI InChI=1S/C14H10N2O4S/c1-18-13(17)6-21-14-9(5-15)2-8-3-11-12(20-7-19-11)4-10(8)16-14/h2-4H,6-7H2,1H3
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n/an/an/an/a 997n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49181
PNG
(5-(4-Benzyl-piperazin-1-ylmethyl)-quinolin-8-ol | ...)
Show SMILES Oc1ccc(CN2CCN(Cc3ccccc3)CC2)c2cccnc12
Show InChI InChI=1S/C21H23N3O/c25-20-9-8-18(19-7-4-10-22-21(19)20)16-24-13-11-23(12-14-24)15-17-5-2-1-3-6-17/h1-10,25H,11-16H2
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n/an/an/an/a 5.24E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49182
PNG
(2-furfuryl-[4-(4-methoxyphenyl)thiazol-2-yl]amine ...)
Show SMILES COc1ccc(cc1)-c1csc(NCc2ccco2)n1
Show InChI InChI=1S/C15H14N2O2S/c1-18-12-6-4-11(5-7-12)14-10-20-15(17-14)16-9-13-3-2-8-19-13/h2-8,10H,9H2,1H3,(H,16,17)
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n/an/an/an/a 3.70E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM34569
PNG
(1-(8-Hydroxy-quinolin-5-ylmethyl)-piperidine-4-car...)
Show SMILES CCOC(=O)C1CCN(Cc2ccc(O)c3ncccc23)CC1
Show InChI InChI=1S/C18H22N2O3/c1-2-23-18(22)13-7-10-20(11-8-13)12-14-5-6-16(21)17-15(14)4-3-9-19-17/h3-6,9,13,21H,2,7-8,10-12H2,1H3
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n/an/an/an/a 2.51E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49183
PNG
((6E)-6-(5-butyl-1H-pyridin-2-ylidene)-3-methyl-1-c...)
Show SMILES CCCCc1ccc(nc1)-c1ccc(C)cc1O
Show InChI InChI=1S/C16H19NO/c1-3-4-5-13-7-9-15(17-11-13)14-8-6-12(2)10-16(14)18/h6-11,18H,3-5H2,1-2H3
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n/an/an/an/a 3.25E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49184
PNG
((4-aminoquinazolin-2-yl)-(3-fluorophenyl)amine;hyd...)
Show SMILES Nc1nc(Nc2cccc(F)c2)nc2ccccc12
Show InChI InChI=1S/C14H11FN4/c15-9-4-3-5-10(8-9)17-14-18-12-7-2-1-6-11(12)13(16)19-14/h1-8H,(H3,16,17,18,19)
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n/an/an/an/a 1.03E+5n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49185
PNG
(1-(3-Fluoro-phenyl)-3-(4-methyl-pyridin-2-yl)-urea...)
Show SMILES Cc1ccnc(NC(=O)Nc2cccc(F)c2)c1
Show InChI InChI=1S/C13H12FN3O/c1-9-5-6-15-12(7-9)17-13(18)16-11-4-2-3-10(14)8-11/h2-8H,1H3,(H2,15,16,17,18)
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n/an/an/an/a 608n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49186
PNG
(4-Methyl-4H-thieno[3,2-b]pyrrole-5-carboxylic acid...)
Show SMILES Cn1c(cc2sccc12)C(=O)Nc1ccc2OCOc2c1
Show InChI InChI=1S/C15H12N2O3S/c1-17-10-4-5-21-14(10)7-11(17)15(18)16-9-2-3-12-13(6-9)20-8-19-12/h2-7H,8H2,1H3,(H,16,18)
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n/an/an/an/a 5.24E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM39430
PNG
((3-Cyano-7-methyl-quinolin-2-ylsulfanyl)-acetic ac...)
Show SMILES COC(=O)CSc1nc2cc(C)ccc2cc1C#N
Show InChI InChI=1S/C14H12N2O2S/c1-9-3-4-10-6-11(7-15)14(16-12(10)5-9)19-8-13(17)18-2/h3-6H,8H2,1-2H3
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n/an/an/an/a 6.53E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49187
PNG
(4-Methyl-4H-thieno[3,2-b]pyrrole-5-carboxylic acid...)
Show SMILES Cn1c(cc2sccc12)C(=O)Nc1ccc2OCCOc2c1
Show InChI InChI=1S/C16H14N2O3S/c1-18-11-4-7-22-15(11)9-12(18)16(19)17-10-2-3-13-14(8-10)21-6-5-20-13/h2-4,7-9H,5-6H2,1H3,(H,17,19)
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n/an/an/an/a 1.17E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49188
PNG
(5-[(3-Methyl-pyridin-2-ylamino)-methyl]-quinolin-8...)
Show SMILES Cc1cccnc1NCc1ccc(O)c2ncccc12
Show InChI InChI=1S/C16H15N3O/c1-11-4-2-9-18-16(11)19-10-12-6-7-14(20)15-13(12)5-3-8-17-15/h2-9,20H,10H2,1H3,(H,18,19)
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n/an/an/an/a 7.65E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49189
PNG
(2-(2-pyridinylmethylthio)-3-quinolinecarbonitrile ...)
Show SMILES N#Cc1cc2ccccc2nc1SCc1ccccn1
Show InChI InChI=1S/C16H11N3S/c17-10-13-9-12-5-1-2-7-15(12)19-16(13)20-11-14-6-3-4-8-18-14/h1-9H,11H2
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n/an/an/an/a 1.51E+5n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49190
PNG
((3-Cyano-7-ethoxy-quinolin-2-ylsulfanyl)-acetic ac...)
Show SMILES CCOc1ccc2cc(C#N)c(SCC(=O)OC)nc2c1
Show InChI InChI=1S/C15H14N2O3S/c1-3-20-12-5-4-10-6-11(8-16)15(17-13(10)7-12)21-9-14(18)19-2/h4-7H,3,9H2,1-2H3
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n/an/an/an/a 1.45E+4n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49191
PNG
(2-(2-thenoylamino)-1,3-benzothiazole-6-carboxylic ...)
Show SMILES CCOC(=O)c1ccc2nc(NC(=O)c3cccs3)sc2c1
Show InChI InChI=1S/C15H12N2O3S2/c1-2-20-14(19)9-5-6-10-12(8-9)22-15(16-10)17-13(18)11-4-3-7-21-11/h3-8H,2H2,1H3,(H,16,17,18)
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n/an/an/an/a 1.93E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49192
PNG
((3-Cyano-7-methoxy-quinolin-2-ylsulfanyl)-acetic a...)
Show SMILES COC(=O)CSc1nc2cc(OC)ccc2cc1C#N
Show InChI InChI=1S/C14H12N2O3S/c1-18-11-4-3-9-5-10(7-15)14(16-12(9)6-11)20-8-13(17)19-2/h3-6H,8H2,1-2H3
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n/an/an/an/a 295n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM9461
PNG
(5,7-dihydroxy-3-(4-methoxyphenyl)-4H-chromen-4-one...)
Show SMILES COc1ccc(cc1)-c1coc2cc(O)cc(O)c2c1=O
Show InChI InChI=1S/C16H12O5/c1-20-11-4-2-9(3-5-11)12-8-21-14-7-10(17)6-13(18)15(14)16(12)19/h2-8,17-18H,1H3
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n/an/an/an/a 5.59E+4n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM23926
PNG
((E)-resveratrol | 5-[(E)-2-(4-hydroxyphenyl)etheny...)
Show SMILES Oc1ccc(\C=C\c2cc(O)cc(O)c2)cc1
Show InChI InChI=1S/C14H12O3/c15-12-5-3-10(4-6-12)1-2-11-7-13(16)9-14(17)8-11/h1-9,15-17H/b2-1+
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n/an/an/an/a 5.20E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49193
PNG
(2-aminobenzoic acid 2-phenoxyethyl ester | 2-pheno...)
Show SMILES Nc1ccccc1C(=O)OCCOc1ccccc1
Show InChI InChI=1S/C15H15NO3/c16-14-9-5-4-8-13(14)15(17)19-11-10-18-12-6-2-1-3-7-12/h1-9H,10-11,16H2
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n/an/an/an/a 910n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49194
PNG
(1-phenyl-N-(2-phenylethyl)-4-pyrazolo[3,4-d]pyrimi...)
Show SMILES C(Cc1ccccc1)Nc1ncnc2n(ncc12)-c1ccccc1
Show InChI InChI=1S/C19H17N5/c1-3-7-15(8-4-1)11-12-20-18-17-13-23-24(19(17)22-14-21-18)16-9-5-2-6-10-16/h1-10,13-14H,11-12H2,(H,20,21,22)
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n/an/an/an/a 2.74E+4n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM39357
PNG
(6-(4-methoxyphenyl)imidazo[2,1-b][1,3]thiazole | 6...)
Show SMILES COc1ccc(cc1)-c1cn2ccsc2n1
Show InChI InChI=1S/C12H10N2OS/c1-15-10-4-2-9(3-5-10)11-8-14-6-7-16-12(14)13-11/h2-8H,1H3
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n/an/an/an/a 1.25E+4n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM39435
PNG
(2-[(3-cyano-6-pyridin-4-yl-2-pyridinyl)thio]acetic...)
Show SMILES CCOC(=O)CSc1nc(ccc1C#N)-c1ccncc1
Show InChI InChI=1S/C15H13N3O2S/c1-2-20-14(19)10-21-15-12(9-16)3-4-13(18-15)11-5-7-17-8-6-11/h3-8H,2,10H2,1H3
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n/an/an/an/a 6.77E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49195
PNG
(2-[(3-cyano-6-thiophen-2-yl-2-pyridinyl)thio]aceti...)
Show SMILES COC(=O)CSc1nc(ccc1C#N)-c1cccs1
Show InChI InChI=1S/C13H10N2O2S2/c1-17-12(16)8-19-13-9(7-14)4-5-10(15-13)11-3-2-6-18-11/h2-6H,8H2,1H3
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n/an/an/an/a 5.62E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49196
PNG
(7-methoxy-3-(4-methyl-1,3-thiazol-2-yl)chromen-4-o...)
Show SMILES COc1ccc2c(c1)occ(-c1nc(C)cs1)c2=O
Show InChI InChI=1S/C14H11NO3S/c1-8-7-19-14(15-8)11-6-18-12-5-9(17-2)3-4-10(12)13(11)16/h3-7H,1-2H3
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n/an/an/an/a 1.08E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49197
PNG
(6-[(4-chlorophenyl)sulfanylmethyl]-3-methyl-imidaz...)
Show SMILES Cc1csc2nc(CSc3ccc(Cl)cc3)cn12
Show InChI InChI=1S/C13H11ClN2S2/c1-9-7-18-13-15-11(6-16(9)13)8-17-12-4-2-10(14)3-5-12/h2-7H,8H2,1H3
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n/an/an/an/a 9.35E+4n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM39441
PNG
((2Z)-2-[1-(3-hydroxyanilino)ethylidene]-1-benzothi...)
Show SMILES CC(=Nc1cccc(O)c1)c1sc2ccccc2c1O |w:2.2|
Show InChI InChI=1S/C16H13NO2S/c1-10(17-11-5-4-6-12(18)9-11)16-15(19)13-7-2-3-8-14(13)20-16/h2-9,18-19H,1H3
PDB

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n/an/an/an/a 2.20E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM48117
PNG
(3-methyl-6-[(4-methylphenyl)sulfanylmethyl]imidazo...)
Show SMILES Cc1csc2nc(CSc3ccc(C)cc3)cn12
Show InChI InChI=1S/C14H14N2S2/c1-10-3-5-13(6-4-10)17-9-12-7-16-11(2)8-18-14(16)15-12/h3-8H,9H2,1-2H3
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n/an/an/an/a 1.93E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49198
PNG
(2-thienyl-[5-(2-thienyl)-2-thienyl]methanone | MLS...)
Show SMILES O=C(c1cccs1)c1ccc(s1)-c1cccs1
Show InChI InChI=1S/C13H8OS3/c14-13(11-4-2-8-16-11)12-6-5-10(17-12)9-3-1-7-15-9/h1-8H
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n/an/an/an/a 623n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49199
PNG
(5-(1-naphthalenyl)-3-phenyl-1,2,4-oxadiazole | 5-(...)
Show SMILES c1ccc(cc1)-c1noc(n1)-c1cccc2ccccc12
Show InChI InChI=1S/C18H12N2O/c1-2-8-14(9-3-1)17-19-18(21-20-17)16-12-6-10-13-7-4-5-11-15(13)16/h1-12H
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n/an/an/an/a 1.56E+4n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
Transcription factor p65


(Homo sapiens (Human))		BDBM49200
PNG
((E)-3-(3-hydroxyanilino)-1-(4-methylphenyl)-2-prop...)
Show SMILES Cc1ccc(cc1)C(=O)CC=Nc1cccc(O)c1 |w:11.12|
Show InChI InChI=1S/C16H15NO2/c1-12-5-7-13(8-6-12)16(19)9-10-17-14-3-2-4-15(18)11-14/h2-8,10-11,18H,9H2,1H3
PDB

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n/an/an/an/a 559n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair
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