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Compile Data Set for Download or QSAR

Found 1011 hits Enz. Inhib. hit(s) with Target = 'karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b'   
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
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM74989
PNG
(2-(4-keto-5,6-dimethyl-thieno[2,3-d]pyrimidin-3-yl...)
Show SMILES Cc1sc2ncn(CC(=O)NCCCC(=O)N3CCN(Cc4ccc5OCOc5c4)CC3)c(=O)c2c1C
Show InChI InChI=1S/C26H31N5O5S/c1-17-18(2)37-25-24(17)26(34)31(15-28-25)14-22(32)27-7-3-4-23(33)30-10-8-29(9-11-30)13-19-5-6-20-21(12-19)36-16-35-20/h5-6,12,15H,3-4,7-11,13-14,16H2,1-2H3,(H,27,32)
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Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM74990
PNG
(4-chloranyl-N-ethyl-N-(2-methylphenyl)-2-nitro-ben...)
Show SMILES CCN(C(=O)c1ccc(Cl)cc1[N+]([O-])=O)c1ccccc1C
Show InChI InChI=1S/C16H15ClN2O3/c1-3-18(14-7-5-4-6-11(14)2)16(20)13-9-8-12(17)10-15(13)19(21)22/h4-10H,3H2,1-2H3
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Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM74991
PNG
((2,6-difluoropyrimidin-4-yl)-methyl-amine | 2,6-bi...)
Show SMILES CNc1cc(F)nc(F)n1
Show InChI InChI=1S/C5H5F2N3/c1-8-4-2-3(6)9-5(7)10-4/h2H,1H3,(H,8,9,10)
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n/an/an/an/a 2.17E+4n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM74992
PNG
(2-(3-nitrophenyl)-2,3-dihydro-1,3-benzoxazin-4-one...)
Show SMILES [O-][N+](=O)c1cccc(c1)C1NC(=O)c2ccccc2O1
Show InChI InChI=1S/C14H10N2O4/c17-13-11-6-1-2-7-12(11)20-14(15-13)9-4-3-5-10(8-9)16(18)19/h1-8,14H,(H,15,17)
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Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM74993
PNG
(MLS000728709 | N-[4-(2-thenoylamino)furazan-3-yl]t...)
Show SMILES O=C(Nc1nonc1NC(=O)c1cccs1)c1cccs1
Show InChI InChI=1S/C12H8N4O3S2/c17-11(7-3-1-5-20-7)13-9-10(16-19-15-9)14-12(18)8-4-2-6-21-8/h1-6H,(H,13,15,17)(H,14,16,18)
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Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM74994
PNG
((2-esyl-4-tosyl-thiazol-5-yl)-(2-pyridylmethyl)ami...)
Show SMILES CCS(=O)(=O)c1nc(c(NCc2ccccn2)s1)S(=O)(=O)c1ccc(C)cc1
Show InChI InChI=1S/C18H19N3O4S3/c1-3-27(22,23)18-21-17(28(24,25)15-9-7-13(2)8-10-15)16(26-18)20-12-14-6-4-5-11-19-14/h4-11,20H,3,12H2,1-2H3
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Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM74995
PNG
(5-(3-nitrophenyl)-3-propyl-1,2,4-oxadiazole | MLS0...)
Show SMILES CCCc1noc(n1)-c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C11H11N3O3/c1-2-4-10-12-11(17-13-10)8-5-3-6-9(7-8)14(15)16/h3,5-7H,2,4H2,1H3
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Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM47499
PNG
(1-[(Z)-2-(4-chlorophenyl)ethenyl]-9H-pyrido[3,4-b]...)
Show SMILES Clc1ccc(\C=C/c2nccc3c4ccccc4[nH]c23)cc1
Show InChI InChI=1S/C19H13ClN2/c20-14-8-5-13(6-9-14)7-10-18-19-16(11-12-21-18)15-3-1-2-4-17(15)22-19/h1-12,22H/b10-7-
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n/an/an/an/a 8.61E+3n/an/an/an/a



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Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM74996
PNG
(1-{[(2,6-dimethylphenyl)amino]carbonyl}-3-oxo-2-(t...)
Show SMILES Cc1cccc(C)c1NC(=O)C1N(Cc2cccs2)C(=O)C[n+]2ccccc12
Show InChI InChI=1S/C22H21N3O2S/c1-15-7-5-8-16(2)20(15)23-22(27)21-18-10-3-4-11-24(18)14-19(26)25(21)13-17-9-6-12-28-17/h3-12,21H,13-14H2,1-2H3/p+1
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Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM74997
PNG
(9-chloranyl-N-cyclopropyl-5,6,7,8-tetrahydroacridi...)
Show SMILES Clc1c2CCCCc2nc2cc(ccc12)C(=O)NC1CC1
Show InChI InChI=1S/C17H17ClN2O/c18-16-12-3-1-2-4-14(12)20-15-9-10(5-8-13(15)16)17(21)19-11-6-7-11/h5,8-9,11H,1-4,6-7H2,(H,19,21)
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Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM74998
PNG
(1-(5-bromanylthiophen-2-yl)sulfonyl-N-[2-(4-sulfam...)
Show SMILES NS(=O)(=O)c1ccc(CCNC(=O)C2CCN(CC2)S(=O)(=O)c2ccc(Br)s2)cc1
Show InChI InChI=1S/C18H22BrN3O5S3/c19-16-5-6-17(28-16)30(26,27)22-11-8-14(9-12-22)18(23)21-10-7-13-1-3-15(4-2-13)29(20,24)25/h1-6,14H,7-12H2,(H,21,23)(H2,20,24,25)
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Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM74999
PNG
(3-(3-methoxyphenyl)-N-(5-methyl-1,2-oxazol-3-yl)-4...)
Show SMILES COc1cccc(c1)C1=NOC(C1)C(=O)Nc1cc(C)on1
Show InChI InChI=1S/C15H15N3O4/c1-9-6-14(18-21-9)16-15(19)13-8-12(17-22-13)10-4-3-5-11(7-10)20-2/h3-7,13H,8H2,1-2H3,(H,16,18,19)
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PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75000
PNG
(2-methoxyethyl-[5-methyl-2-(p-tolyl)pyrazolo[1,5-a...)
Show SMILES COCCNc1cc(C)nc2cc(nn12)-c1ccc(C)cc1
Show InChI InChI=1S/C17H20N4O/c1-12-4-6-14(7-5-12)15-11-17-19-13(2)10-16(21(17)20-15)18-8-9-22-3/h4-7,10-11,18H,8-9H2,1-3H3
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n/an/an/an/a 3.77E+3n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75001
PNG
(2-furancarboxylic acid [2-methoxy-4-[(E)-(4-oxo-3-...)
Show SMILES COc1cc(\C=C2\SC(=S)N(CC=C)C2=O)ccc1OC(=O)c1ccco1
Show InChI InChI=1S/C19H15NO5S2/c1-3-8-20-17(21)16(27-19(20)26)11-12-6-7-13(15(10-12)23-2)25-18(22)14-5-4-9-24-14/h3-7,9-11H,1,8H2,2H3/b16-11+
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PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75002
PNG
(MLS000720191 | N'-{(1E)-[5-(2-chlorophenyl)-2-...)
Show SMILES Clc1ccccc1-c1ccc(C=NNC(=O)c2ccccc2)o1
Show InChI InChI=1S/C18H13ClN2O2/c19-16-9-5-4-8-15(16)17-11-10-14(23-17)12-20-21-18(22)13-6-2-1-3-7-13/h1-12H,(H,21,22)
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PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75003
PNG
(9-methyl-N-(6-methyl-2-pyridinyl)-4H-thieno[3,2-c]...)
Show SMILES Cc1cccc(NC(=O)c2cc3COc4cccc(C)c4-c3s2)n1
Show InChI InChI=1S/C19H16N2O2S/c1-11-5-3-7-14-17(11)18-13(10-23-14)9-15(24-18)19(22)21-16-8-4-6-12(2)20-16/h3-9H,10H2,1-2H3,(H,20,21,22)
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n/an/an/an/a 7.29E+3n/an/an/an/a



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PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM53985
PNG
(MLS000687796 | N-[(5Z)-4-keto-5-(2-ketoindolin-3-y...)
Show SMILES O=C(NN1C(=S)S\C(C1=O)=C1/C(=O)Nc2ccccc12)c1cccnc1
Show InChI InChI=1S/C17H10N4O3S2/c22-14(9-4-3-7-18-8-9)20-21-16(24)13(26-17(21)25)12-10-5-1-2-6-11(10)19-15(12)23/h1-8H,(H,19,23)(H,20,22)/b13-12-
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PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75004
PNG
(3-(4-ethoxybenzoyl)-7-hydroxy-2H-chromen-2-one | 3...)
Show SMILES CCOc1ccc(cc1)C(=O)c1cc2ccc(O)cc2oc1=O
Show InChI InChI=1S/C18H14O5/c1-2-22-14-7-4-11(5-8-14)17(20)15-9-12-3-6-13(19)10-16(12)23-18(15)21/h3-10,19H,2H2,1H3
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n/an/an/an/a 7.96E+3n/an/an/an/a



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PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75005
PNG
(3-(2-methoxyphenyl)carbonyl-7-oxidanyl-chromen-2-o...)
Show SMILES COc1ccccc1C(=O)c1cc2ccc(O)cc2oc1=O
Show InChI InChI=1S/C17H12O5/c1-21-14-5-3-2-4-12(14)16(19)13-8-10-6-7-11(18)9-15(10)22-17(13)20/h2-9,18H,1H3
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n/an/an/an/a 7.12E+3n/an/an/an/a



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PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM51188
PNG
((6E)-4-(2-chlorobenzyl)-6-[(3,4-dimethoxyanilino)m...)
Show SMILES COc1ccc(cc1OC)\[NH+]=C\c1c[c-](Cc2ccccc2Cl)cc([N+]([O-])=O)c1=O
Show InChI InChI=1S/C22H18ClN2O5/c1-29-20-8-7-17(12-21(20)30-2)24-13-16-10-14(11-19(22(16)26)25(27)28)9-15-5-3-4-6-18(15)23/h3-8,10-13H,9H2,1-2H3/q-1/p+1/b24-13+
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Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75006
PNG
(MLS000419481 | N-(3-cyano-6-ethanoyl-5,7-dihydro-4...)
Show SMILES COc1ccc(cc1)C(=O)Nc1sc2CN(CCc2c1C#N)C(C)=O
Show InChI InChI=1S/C18H17N3O3S/c1-11(22)21-8-7-14-15(9-19)18(25-16(14)10-21)20-17(23)12-3-5-13(24-2)6-4-12/h3-6H,7-8,10H2,1-2H3,(H,20,23)
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Curated by PubChem BioAssay


Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75007
PNG
(6-(4-ethyl-1-piperazinyl)-3-[(4-fluorophenyl)methy...)
Show SMILES CCN1CCN(CC1)c1cc(=O)n(Cc2ccc(F)cc2)c(=O)[nH]1
Show InChI InChI=1S/C17H21FN4O2/c1-2-20-7-9-21(10-8-20)15-11-16(23)22(17(24)19-15)12-13-3-5-14(18)6-4-13/h3-6,11H,2,7-10,12H2,1H3,(H,19,24)
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Curated by PubChem BioAssay


Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75008
PNG
(3-ethyl-6-(4-morpholinyl)-1H-pyrimidine-2,4-dione ...)
Show SMILES CCn1c(=O)cc([nH]c1=O)N1CCOCC1
Show InChI InChI=1S/C10H15N3O3/c1-2-13-9(14)7-8(11-10(13)15)12-3-5-16-6-4-12/h7H,2-6H2,1H3,(H,11,15)
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Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75009
PNG
(4-[2,4-diketo-3-(o-tolyl)-1H-pyrimidin-6-yl]pipera...)
Show SMILES CCOC(=O)N1CCN(CC1)c1cc(=O)n(-c2ccccc2C)c(=O)[nH]1
Show InChI InChI=1S/C18H22N4O4/c1-3-26-18(25)21-10-8-20(9-11-21)15-12-16(23)22(17(24)19-15)14-7-5-4-6-13(14)2/h4-7,12H,3,8-11H2,1-2H3,(H,19,24)
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Curated by PubChem BioAssay


Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM45650
PNG
((3Z)-1-allyl-5-(morpholin-4-ylsulfonyl)-1H-indole-...)
Show SMILES Fc1ccccc1NC(=S)NN=C1C(=O)N(CC=C)c2ccc(cc12)S(=O)(=O)N1CCOCC1
Show InChI InChI=1S/C22H22FN5O4S2/c1-2-9-28-19-8-7-15(34(30,31)27-10-12-32-13-11-27)14-16(19)20(21(28)29)25-26-22(33)24-18-6-4-3-5-17(18)23/h2-8,14H,1,9-13H2,(H2,24,26,33)
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Curated by PubChem BioAssay


Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75010
PNG
(2-(pivaloylamino)-1,3-benzothiazole-6-carboxylic a...)
Show SMILES COC(=O)c1ccc2nc(NC(=O)C(C)(C)C)sc2c1
Show InChI InChI=1S/C14H16N2O3S/c1-14(2,3)12(18)16-13-15-9-6-5-8(11(17)19-4)7-10(9)20-13/h5-7H,1-4H3,(H,15,16,18)
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Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75011
PNG
(MLS000419438 | N'-(1,3-dimethyl-2,6-dioxo-4-pyrimi...)
Show SMILES Cn1c(NNC(=O)c2cccc3ccccc23)cc(=O)n(C)c1=O
Show InChI InChI=1S/C17H16N4O3/c1-20-14(10-15(22)21(2)17(20)24)18-19-16(23)13-9-5-7-11-6-3-4-8-12(11)13/h3-10,18H,1-2H3,(H,19,23)
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n/an/an/an/a 1.36E+5n/an/an/an/a



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Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75012
PNG
(5-[2-(2-ethyl-1-piperidinyl)-2-oxoethoxy]-2-methyl...)
Show SMILES CCC1CCCCN1C(=O)COc1cccc2C(=O)N(C)CCc12
Show InChI InChI=1S/C19H26N2O3/c1-3-14-7-4-5-11-21(14)18(22)13-24-17-9-6-8-16-15(17)10-12-20(2)19(16)23/h6,8-9,14H,3-5,7,10-13H2,1-2H3
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Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75013
PNG
(3-methyl-2-[(3-nitrobenzyl)thio]-6,7-dihydrothieno...)
Show SMILES Cn1c(SCc2cccc(c2)[N+]([O-])=O)nc2CCSc2c1=O
Show InChI InChI=1S/C14H13N3O3S2/c1-16-13(18)12-11(5-6-21-12)15-14(16)22-8-9-3-2-4-10(7-9)17(19)20/h2-4,7H,5-6,8H2,1H3
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Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75014
PNG
(2-[2-[5-(4-bromophenyl)-3-(4-fluorophenyl)-3,4-dih...)
Show SMILES Fc1ccc(cc1)C1CC(=NN1C(=O)CSC1=NN2CCCC(=O)N=C2S1)c1ccc(Br)cc1
Show InChI InChI=1S/C23H19BrFN5O2S2/c24-16-7-3-14(4-8-16)18-12-19(15-5-9-17(25)10-6-15)30(27-18)21(32)13-33-23-28-29-11-1-2-20(31)26-22(29)34-23/h3-10,19H,1-2,11-13H2
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Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75015
PNG
(3-ketobenzo[f]chromene-2-carbonitrile | 3-oxidanyl...)
Show SMILES O=c1oc2ccc3ccccc3c2cc1C#N
Show InChI InChI=1S/C14H7NO2/c15-8-10-7-12-11-4-2-1-3-9(11)5-6-13(12)17-14(10)16/h1-7H
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Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75016
PNG
(7-methoxy-2-(4-o-toluoylpiperazino)quinoline-3-car...)
Show SMILES COc1ccc2cc(C#N)c(nc2c1)N1CCN(CC1)C(=O)c1ccccc1C
Show InChI InChI=1S/C23H22N4O2/c1-16-5-3-4-6-20(16)23(28)27-11-9-26(10-12-27)22-18(15-24)13-17-7-8-19(29-2)14-21(17)25-22/h3-8,13-14H,9-12H2,1-2H3
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Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75017
PNG
((2,4-dichlorophenyl)-[1-methyl-5-(methyloximinomet...)
Show SMILES CON=Cc1cc(cn1C)C(=O)c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C14H12Cl2N2O2/c1-18-8-9(5-11(18)7-17-20-2)14(19)12-4-3-10(15)6-13(12)16/h3-8H,1-2H3
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Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75018
PNG
(3-(2-hydroxyethyl)-2-[(E)-2-(2-methyl-1H-indol-3-y...)
Show SMILES Cc1[nH]c2ccccc2c1\C=C\c1nc2ccccc2c(=O)n1CCO
Show InChI InChI=1S/C21H19N3O2/c1-14-15(16-6-2-4-8-18(16)22-14)10-11-20-23-19-9-5-3-7-17(19)21(26)24(20)12-13-25/h2-11,22,25H,12-13H2,1H3/b11-10+
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Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75019
PNG
((1E,4E)-1-(4-chlorophenyl)-5-(dimethylamino)-3-pen...)
Show SMILES CN(C)\C=C\C(=O)\C=C\c1ccc(Cl)cc1
Show InChI InChI=1S/C13H14ClNO/c1-15(2)10-9-13(16)8-5-11-3-6-12(14)7-4-11/h3-10H,1-2H3/b8-5+,10-9+
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Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75020
PNG
((5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)-(3-pyrid...)
Show SMILES Cc1sc2ncnc(NCc3cccnc3)c2c1C
Show InChI InChI=1S/C14H14N4S/c1-9-10(2)19-14-12(9)13(17-8-18-14)16-7-11-4-3-5-15-6-11/h3-6,8H,7H2,1-2H3,(H,16,17,18)
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Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75021
PNG
(1H-pyrazole-3,5-dicarboxylic acid dimethyl ester |...)
Show SMILES COC(=O)c1cc([nH]n1)C(=O)OC
Show InChI InChI=1S/C7H8N2O4/c1-12-6(10)4-3-5(9-8-4)7(11)13-2/h3H,1-2H3,(H,8,9)
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Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75022
PNG
(5-(ethoxalylamino)benzene-1,3-dicarboxylic acid di...)
Show SMILES CCOC(=O)C(=O)Nc1cc(cc(c1)C(=O)OC)C(=O)OC
Show InChI InChI=1S/C14H15NO7/c1-4-22-14(19)11(16)15-10-6-8(12(17)20-2)5-9(7-10)13(18)21-3/h5-7H,4H2,1-3H3,(H,15,16)
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Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75023
PNG
(1-[4-[(4-chlorophenyl)thio]-3-nitro-benzyl]pyrroli...)
Show SMILES [O-][N+](=O)c1cc(CN2CCCC2)ccc1Sc1ccc(Cl)cc1
Show InChI InChI=1S/C17H17ClN2O2S/c18-14-4-6-15(7-5-14)23-17-8-3-13(11-16(17)20(21)22)12-19-9-1-2-10-19/h3-8,11H,1-2,9-10,12H2
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Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75024
PNG
(2-hydroxy-4-keto-1-propyl-2-pyrroline-3-carbonitri...)
Show SMILES CCCn1cc(O)c(C#N)c1O
Show InChI InChI=1S/C8H10N2O2/c1-2-3-10-5-7(11)6(4-9)8(10)12/h5,11-12H,2-3H2,1H3
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Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75025
PNG
(4-[4-(dimethylamino)phenyl]-1-methyl-2-(methylthio...)
Show SMILES CSc1nc(-c2ccc(cc2)N(C)C)c(C#N)c(=O)n1C
Show InChI InChI=1S/C15H16N4OS/c1-18(2)11-7-5-10(6-8-11)13-12(9-16)14(20)19(3)15(17-13)21-4/h5-8H,1-4H3
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n/an/an/an/a 9.42E+3n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75026
PNG
(1-(3-{[4-(4-fluorophenyl)piperazin-1-yl]methyl}-4-...)
Show SMILES COc1ccc(cc1CN1CCN(CC1)c1ccc(F)cc1)C1NC(Cc2c1[nH]c1ccccc21)C(O)=O
Show InChI InChI=1S/C30H31FN4O3/c1-38-27-11-6-19(16-20(27)18-34-12-14-35(15-13-34)22-9-7-21(31)8-10-22)28-29-24(17-26(33-28)30(36)37)23-4-2-3-5-25(23)32-29/h2-11,16,26,28,32-33H,12-15,17-18H2,1H3,(H,36,37)
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n/an/an/an/a 8.57E+3n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75027
PNG
(MLS000691875 | N-(5,6-dihydrobenzo[h]quinazolin-2-...)
Show SMILES CC(C)SCC(=O)Nc1ncc2CCc3ccccc3-c2n1
Show InChI InChI=1S/C17H19N3OS/c1-11(2)22-10-15(21)19-17-18-9-13-8-7-12-5-3-4-6-14(12)16(13)20-17/h3-6,9,11H,7-8,10H2,1-2H3,(H,18,19,20,21)
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n/an/an/an/a 3.48E+3n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75028
PNG
(4-chloranyl-N-(2-pyridin-4-ylpyrimidin-4-yl)benzam...)
Show SMILES Clc1ccc(cc1)C(=O)Nc1ccnc(n1)-c1ccncc1
Show InChI InChI=1S/C16H11ClN4O/c17-13-3-1-12(2-4-13)16(22)21-14-7-10-19-15(20-14)11-5-8-18-9-6-11/h1-10H,(H,19,20,21,22)
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n/an/an/an/a>5.00E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75029
PNG
(MLS000686692 | N-phenyl-4-tetrazolo[1,5-a]quinoxal...)
Show SMILES N(c1ccccc1)c1nc2ccccc2n2nnnc12
Show InChI InChI=1S/C14H10N6/c1-2-6-10(7-3-1)15-13-14-17-18-19-20(14)12-9-5-4-8-11(12)16-13/h1-9H,(H,15,16)
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n/an/an/an/a 2.40E+4n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75030
PNG
(2-(2,6-dimethylmorpholin-4-yl)-5-ethanoyl-6-methyl...)
Show SMILES CC1CN(CC(C)O1)c1nc(C)c(cc1C#N)C(C)=O
Show InChI InChI=1S/C15H19N3O2/c1-9-7-18(8-10(2)20-9)15-13(6-16)5-14(12(4)19)11(3)17-15/h5,9-10H,7-8H2,1-4H3
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n/an/an/an/a>5.00E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75031
PNG
((3Z)-3-[(2,6-dimethylanilino)-hydroxy-methylene]-2...)
Show SMILES CN1c2ccsc2C(=O)C(C(=O)Nc2c(C)cccc2C)S1(=O)=O
Show InChI InChI=1S/C16H16N2O4S2/c1-9-5-4-6-10(2)12(9)17-16(20)15-13(19)14-11(7-8-23-14)18(3)24(15,21)22/h4-8,15H,1-3H3,(H,17,20)
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n/an/an/an/a 2.28E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75032
PNG
(MLS000691962 | N,N-dimethyl-N'-[7-(2-thienyl)[...)
Show SMILES CN(C)C=Nc1nc2nccc(-c3cccs3)n2n1
Show InChI InChI=1S/C12H12N6S/c1-17(2)8-14-11-15-12-13-6-5-9(18(12)16-11)10-4-3-7-19-10/h3-8H,1-2H3
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n/an/an/an/a 1.38E+4n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75033
PNG
(5-({[(1-methyl-1H-tetrazol-5-yl)thio]acetyl}amino)...)
Show SMILES Cn1nnnc1SCC(=O)Nc1nn(nc1C(N)=O)-c1ccccc1
Show InChI InChI=1S/C13H13N9O2S/c1-21-13(16-19-20-21)25-7-9(23)15-12-10(11(14)24)17-22(18-12)8-5-3-2-4-6-8/h2-6H,7H2,1H3,(H2,14,24)(H,15,18,23)
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n/an/an/an/a>5.00E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
karyopherin alpha 2 (RAG cohort 1, importin alpha 1), isoform CRA_b


(Homo sapiens)
BDBM75034
PNG
(2-[4,5-dimethoxy-2-(methylsulfamoyl)phenyl]acetic ...)
Show SMILES CNS(=O)(=O)c1cc(OC)c(OC)cc1CC(=O)OC
Show InChI InChI=1S/C12H17NO6S/c1-13-20(15,16)11-7-10(18-3)9(17-2)5-8(11)6-12(14)19-4/h5,7,13H,6H2,1-4H3
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n/an/an/an/a>5.00E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Counterscreen, FRET assay, HTS, YIC probe, Dose response, Assay Overview: This is a fluorescence resonance energy transfer (FRET)-based b...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q280513R
More data for this
Ligand-Target Pair
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