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Compile Data Set for Download or QSAR

Found 202 hits of ki for monomerid = 13063   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM34966
PNG
(3-(3-keto-1,2-benzothiazol-2-yl)-N,N-dimethyl-benz...)
Show SMILES CN(C)S(=O)(=O)c1cccc(c1)-n1sc2ccccc2c1=O
Show InChI InChI=1S/C15H14N2O3S2/c1-16(2)22(19,20)12-7-5-6-11(10-12)17-15(18)13-8-3-4-9-14(13)21-17/h3-10H,1-2H3
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n/an/a 7.06E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM33178
PNG
((4-bromophenyl)-(4-chlorodithiazol-5-ylidene)amine...)
Show SMILES Clc1nss\c1=N/c1ccc(Br)cc1
Show InChI InChI=1S/C8H4BrClN2S2/c9-5-1-3-6(4-2-5)11-8-7(10)12-14-13-8/h1-4H/b11-8-
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n/an/a 7.28E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46720
PNG
((3-bromo-2-nitro-phenyl)-(4-chlorodithiazol-5-ylid...)
Show SMILES [O-][N+](=O)c1c(Br)cccc1\N=c1\ssnc1Cl
Show InChI InChI=1S/C8H3BrClN3O2S2/c9-4-2-1-3-5(6(4)13(14)15)11-8-7(10)12-17-16-8/h1-3H/b11-8+
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n/an/a 7.37E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46646
PNG
(2-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phen...)
Show SMILES O=c1n(sc2ccccc12)-c1cc(ccc1N1CCCC1)S(=O)(=O)N1CCOCC1
Show InChI InChI=1S/C21H23N3O4S2/c25-21-17-5-1-2-6-20(17)29-24(21)19-15-16(7-8-18(19)22-9-3-4-10-22)30(26,27)23-11-13-28-14-12-23/h1-2,5-8,15H,3-4,9-14H2
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n/an/a 7.51E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46035
PNG
(2-(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)-1,...)
Show SMILES Clc1ccc(cc1S(=O)(=O)N1CCOCC1)-n1sc2ccccc2c1=O
Show InChI InChI=1S/C17H15ClN2O4S2/c18-14-6-5-12(20-17(21)13-3-1-2-4-15(13)25-20)11-16(14)26(22,23)19-7-9-24-10-8-19/h1-6,11H,7-10H2
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n/an/a 8.58E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM33179
PNG
(2-[(4-chloranyl-1,2,3-dithiazol-5-ylidene)amino]an...)
Show SMILES Nc1ccccc1\N=c1\ssnc1Cl
Show InChI InChI=1S/C8H6ClN3S2/c9-7-8(13-14-12-7)11-6-4-2-1-3-5(6)10/h1-4H,10H2/b11-8+
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n/an/a 9.43E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46678
PNG
(2-[(4-chloranyl-1,2,3-dithiazol-5-ylidene)amino]-N...)
Show SMILES Clc1nss\c1=N\c1ccccc1Nc1ccc(Cl)cc1
Show InChI InChI=1S/C14H9Cl2N3S2/c15-9-5-7-10(8-6-9)17-11-3-1-2-4-12(11)18-14-13(16)19-21-20-14/h1-8,17H/b18-14+
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n/an/a 9.77E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46662
PNG
(3-[3-(3-bromophenyl)-4-[(4,6-diketo-2-thioxo-hexah...)
Show SMILES [#8]-[#6](=O)-[#6]-[#6]-n1cc(\[#6]=[#6]-2\[#6](=O)-[#7]-[#6](=S)-[#7]-[#6]-2=O)c(n1)-c1cccc(Br)c1
Show InChI InChI=1S/C17H13BrN4O4S/c18-11-3-1-2-9(6-11)14-10(8-22(21-14)5-4-13(23)24)7-12-15(25)19-17(27)20-16(12)26/h1-3,6-8H,4-5H2,(H,23,24)(H2,19,20,25,26,27)
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n/an/a 9.83E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46738
PNG
((4-chlorodithiazol-5-ylidene)-(2-chloro-3-pyridyl)...)
Show SMILES Clc1nss\c1=N\c1cccnc1Cl
Show InChI InChI=1S/C7H3Cl2N3S2/c8-5-4(2-1-3-10-5)11-7-6(9)12-14-13-7/h1-3H/b11-7+
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n/an/a 9.88E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46706
PNG
(2-(2-naphthalenyl)-1,2-benzothiazol-3-one | 2-(2-n...)
Show SMILES O=c1n(sc2ccccc12)-c1ccc2ccccc2c1
Show InChI InChI=1S/C17H11NOS/c19-17-15-7-3-4-8-16(15)20-18(17)14-10-9-12-5-1-2-6-13(12)11-14/h1-11H
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n/an/a 1.07E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46733
PNG
(5-fluoranyl-2-(3-fluorophenyl)-1,2-benzothiazol-3-...)
Show SMILES Fc1cccc(c1)-n1sc2ccc(F)cc2c1=O
Show InChI InChI=1S/C13H7F2NOS/c14-8-2-1-3-10(6-8)16-13(17)11-7-9(15)4-5-12(11)18-16/h1-7H
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n/an/a 1.11E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46690
PNG
(2-[3-(dimethylamino)phenyl]-1,2-benzothiazol-3-one...)
Show SMILES CN(C)c1cccc(c1)-n1sc2ccccc2c1=O
Show InChI InChI=1S/C15H14N2OS/c1-16(2)11-6-5-7-12(10-11)17-15(18)13-8-3-4-9-14(13)19-17/h3-10H,1-2H3
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n/an/a 1.12E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46718
PNG
((4-chlorodithiazol-5-ylidene)-(4-fluorophenyl)amin...)
Show SMILES Fc1ccc(cc1)\N=c1\ssnc1Cl
Show InChI InChI=1S/C8H4ClFN2S2/c9-7-8(13-14-12-7)11-6-3-1-5(10)2-4-6/h1-4H/b11-8+
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n/an/a 1.16E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46722
PNG
((2-bromophenyl)-(4-chlorodithiazol-5-ylidene)amine...)
Show SMILES Clc1nss\c1=N\c1ccccc1Br
Show InChI InChI=1S/C8H4BrClN2S2/c9-5-3-1-2-4-6(5)11-8-7(10)12-14-13-8/h1-4H/b11-8+
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n/an/a 1.19E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46729
PNG
((4-chlorodithiazol-5-ylidene)-(2-methoxyethyl)amin...)
Show SMILES COCC\N=c1/ssnc1Cl
Show InChI InChI=1S/C5H7ClN2OS2/c1-9-3-2-7-5-4(6)8-11-10-5/h2-3H2,1H3/b7-5-
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n/an/a 1.19E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46613
PNG
(2-(3-chloranyl-4-fluoranyl-phenyl)-4,6-dinitro-1,2...)
Show SMILES [O-][N+](=O)c1cc([N+]([O-])=O)c2c(c1)sn(-c1ccc(F)c(Cl)c1)c2=O
Show InChI InChI=1S/C13H5ClFN3O5S/c14-8-3-6(1-2-9(8)15)16-13(19)12-10(18(22)23)4-7(17(20)21)5-11(12)24-16/h1-5H
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n/an/a 1.20E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46637
PNG
(2-(4-bromophenyl)-4,6-dinitro-1,2-benzothiazol-3-o...)
Show SMILES [O-][N+](=O)c1cc([N+]([O-])=O)c2c(c1)sn(-c1ccc(Br)cc1)c2=O
Show InChI InChI=1S/C13H6BrN3O5S/c14-7-1-3-8(4-2-7)15-13(18)12-10(17(21)22)5-9(16(19)20)6-11(12)23-15/h1-6H
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n/an/a 1.22E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46699
PNG
(4-[(4-chloranyl-1,2,3-dithiazol-5-ylidene)amino]-N...)
Show SMILES CN(C)c1ccc(cc1)\N=c1\ssnc1Cl
Show InChI InChI=1S/C10H10ClN3S2/c1-14(2)8-5-3-7(4-6-8)12-10-9(11)13-16-15-10/h3-6H,1-2H3/b12-10+
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n/an/a 1.24E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM34672
PNG
((4-chlorodithiazol-5-ylidene)-(4-chlorophenyl)amin...)
Show SMILES Clc1nss\c1=N\c1ccc(Cl)cc1
Show InChI InChI=1S/C8H4Cl2N2S2/c9-5-1-3-6(4-2-5)11-8-7(10)12-14-13-8/h1-4H/b11-8+
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n/an/a 1.25E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46724
PNG
((Z)-(4-chlorodithiazol-5-ylidene)-(5-ethyl-1,3,4-t...)
Show SMILES CCc1nnc(\N=c2/ssnc2Cl)s1
Show InChI InChI=1S/C6H5ClN4S3/c1-2-3-9-10-6(12-3)8-5-4(7)11-14-13-5/h2H2,1H3/b8-5-
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n/an/a 1.31E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46713
PNG
((4-chlorodithiazol-5-ylidene)-(3-pyridyl)amine | 4...)
Show SMILES Clc1nss\c1=N/c1cccnc1
Show InChI InChI=1S/C7H4ClN3S2/c8-6-7(12-13-11-6)10-5-2-1-3-9-4-5/h1-4H/b10-7-
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n/an/a 1.32E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46714
PNG
((4-chlorodithiazol-5-ylidene)-(2-naphthyl)amine | ...)
Show SMILES Clc1nss\c1=N\c1ccc2ccccc2c1
Show InChI InChI=1S/C12H7ClN2S2/c13-11-12(16-17-15-11)14-10-6-5-8-3-1-2-4-9(8)7-10/h1-7H/b14-12+
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n/an/a 1.41E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46625
PNG
(2-(2,4-dichlorophenyl)-6-fluoranyl-1,2-benzothiazo...)
Show SMILES Fc1ccc2c(c1)sn(-c1ccc(Cl)cc1Cl)c2=O
Show InChI InChI=1S/C13H6Cl2FNOS/c14-7-1-4-11(10(15)5-7)17-13(18)9-3-2-8(16)6-12(9)19-17/h1-6H
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n/an/a 1.44E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46710
PNG
((4-chlorodithiazol-5-ylidene)-p-anisyl-amine | 4-c...)
Show SMILES COc1ccc(C\N=c2/ssnc2Cl)cc1
Show InChI InChI=1S/C10H9ClN2OS2/c1-14-8-4-2-7(3-5-8)6-12-10-9(11)13-16-15-10/h2-5H,6H2,1H3/b12-10-
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n/an/a 1.55E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46730
PNG
((4-chlorodithiazol-5-ylidene)-cyclobutyl-amine | 4...)
Show SMILES Clc1nss\c1=N/C1CCC1
Show InChI InChI=1S/C6H7ClN2S2/c7-5-6(10-11-9-5)8-4-2-1-3-4/h4H,1-3H2/b8-6-
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n/an/a 1.56E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46686
PNG
((4-chlorodithiazol-5-ylidene)-phenyl-amine | 4-chl...)
Show SMILES Clc1nss\c1=N\c1ccccc1
Show InChI InChI=1S/C8H5ClN2S2/c9-7-8(12-13-11-7)10-6-4-2-1-3-5-6/h1-5H/b10-8+
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n/an/a 1.57E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46665
PNG
(4-[(4-methylbenzylidene)amino]-3-(4-pyridyl)-1H-1,...)
Show SMILES Cc1ccc(C=Nn2c(n[nH]c2=S)-c2ccncc2)cc1 |w:6.6|
Show InChI InChI=1S/C15H13N5S/c1-11-2-4-12(5-3-11)10-17-20-14(18-19-15(20)21)13-6-8-16-9-7-13/h2-10H,1H3,(H,19,21)
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n/an/a 1.61E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46713
PNG
((4-chlorodithiazol-5-ylidene)-(3-pyridyl)amine | 4...)
Show SMILES Clc1nss\c1=N/c1cccnc1
Show InChI InChI=1S/C7H4ClN3S2/c8-6-7(12-13-11-6)10-5-2-1-3-9-4-5/h1-4H/b10-7-
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n/an/a 1.67E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46702
PNG
((4-chlorodithiazol-5-ylidene)-(3,4-dichlorophenyl)...)
Show SMILES Clc1nss\c1=N/c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C8H3Cl3N2S2/c9-5-2-1-4(3-6(5)10)12-8-7(11)13-15-14-8/h1-3H/b12-8-
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n/an/a 1.69E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM33049
PNG
((4-chlorodithiazol-5-ylidene)-(3,5-dimethoxyphenyl...)
Show SMILES COc1cc(OC)cc(c1)\N=c1\ssnc1Cl
Show InChI InChI=1S/C10H9ClN2O2S2/c1-14-7-3-6(4-8(5-7)15-2)12-10-9(11)13-17-16-10/h3-5H,1-2H3/b12-10+
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n/an/a 1.72E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM34927
PNG
(5-(4-methoxybenzyl)-1,3,4-thiadiazole-2-thiol | 5-...)
Show SMILES COc1ccc(Cc2nnc(S)s2)cc1
Show InChI InChI=1S/C10H10N2OS2/c1-13-8-4-2-7(3-5-8)6-9-11-12-10(14)15-9/h2-5H,6H2,1H3,(H,12,14)
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n/an/a 1.80E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46685
PNG
((4-chlorodithiazol-5-ylidene)-(p-tolyl)amine | 4-c...)
Show SMILES Cc1ccc(cc1)\N=c1\ssnc1Cl
Show InChI InChI=1S/C9H7ClN2S2/c1-6-2-4-7(5-3-6)11-9-8(10)12-14-13-9/h2-5H,1H3/b11-9+
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n/an/a 1.86E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46725
PNG
((Z)-(4-chlorodithiazol-5-ylidene)-[5-(trifluoromet...)
Show SMILES FC(F)(F)c1nnc(\N=c2/ssnc2Cl)s1
Show InChI InChI=1S/C5ClF3N4S3/c6-1-2(15-16-13-1)10-4-12-11-3(14-4)5(7,8)9/b10-2-
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n/an/a 2.08E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46707
PNG
(2-[4-(dimethylamino)phenyl]-1,2-benzothiazol-3-one...)
Show SMILES CN(C)c1ccc(cc1)-n1sc2ccccc2c1=O
Show InChI InChI=1S/C15H14N2OS/c1-16(2)11-7-9-12(10-8-11)17-15(18)13-5-3-4-6-14(13)19-17/h3-10H,1-2H3
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n/an/a 2.14E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46721
PNG
((4-chlorodithiazol-5-ylidene)-(2-methoxy-5-methyl-...)
Show SMILES COc1ccc(C)cc1\N=c1/ssnc1Cl
Show InChI InChI=1S/C10H9ClN2OS2/c1-6-3-4-8(14-2)7(5-6)12-10-9(11)13-16-15-10/h3-5H,1-2H3/b12-10-
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n/an/a 2.25E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46648
PNG
(2-(5-nitro-1,3-thiazol-2-yl)-1,2-benzothiazol-3-on...)
Show SMILES [O-][N+](=O)c1cnc(s1)-n1sc2ccccc2c1=O
Show InChI InChI=1S/C10H5N3O3S2/c14-9-6-3-1-2-4-7(6)18-12(9)10-11-5-8(17-10)13(15)16/h1-5H
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n/an/a 2.27E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46628
PNG
(2-(2,3-dimethylphenyl)-6-fluoranyl-1,2-benzothiazo...)
Show SMILES Cc1cccc(c1C)-n1sc2cc(F)ccc2c1=O
Show InChI InChI=1S/C15H12FNOS/c1-9-4-3-5-13(10(9)2)17-15(18)12-7-6-11(16)8-14(12)19-17/h3-8H,1-2H3
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n/an/a 2.27E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46717
PNG
((4-chlorodithiazol-5-ylidene)-(4-nitrophenyl)amine...)
Show SMILES [O-][N+](=O)c1ccc(cc1)\N=c1\ssnc1Cl
Show InChI InChI=1S/C8H4ClN3O2S2/c9-7-8(15-16-11-7)10-5-1-3-6(4-2-5)12(13)14/h1-4H/b10-8+
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n/an/a 2.30E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46038
PNG
(4-(3-keto-1,2-benzothiazol-2-yl)benzoic acid ethyl...)
Show SMILES CCOC(=O)c1ccc(cc1)-n1sc2ccccc2c1=O
Show InChI InChI=1S/C16H13NO3S/c1-2-20-16(19)11-7-9-12(10-8-11)17-15(18)13-5-3-4-6-14(13)21-17/h3-10H,2H2,1H3
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n/an/a 2.36E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46715
PNG
((4-chlorodithiazol-5-ylidene)-(6-quinolyl)amine | ...)
Show SMILES Clc1nss\c1=N\c1ccc2ncccc2c1
Show InChI InChI=1S/C11H6ClN3S2/c12-10-11(16-17-15-10)14-8-3-4-9-7(6-8)2-1-5-13-9/h1-6H/b14-11+
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n/an/a 2.36E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46700
PNG
((4-tert-butylphenyl)-(4-chlorodithiazol-5-ylidene)...)
Show SMILES CC(C)(C)c1ccc(cc1)\N=c1/ssnc1Cl
Show InChI InChI=1S/C12H13ClN2S2/c1-12(2,3)8-4-6-9(7-5-8)14-11-10(13)15-17-16-11/h4-7H,1-3H3/b14-11-
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n/an/a 2.36E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46693
PNG
(2-[3-(trifluoromethyl)phenyl]-1,2-benzothiazol-3-o...)
Show SMILES FC(F)(F)c1cccc(c1)-n1sc2ccccc2c1=O
Show InChI InChI=1S/C14H8F3NOS/c15-14(16,17)9-4-3-5-10(8-9)18-13(19)11-6-1-2-7-12(11)20-18/h1-8H
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n/an/a 2.37E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46656
PNG
(2-(diethylamino)ethyl 4-(3-oxidanylidene-1,2-benzo...)
Show SMILES CCN(CC)CCOC(=O)c1ccc(cc1)-n1sc2ccccc2c1=O
Show InChI InChI=1S/C20H22N2O3S/c1-3-21(4-2)13-14-25-20(24)15-9-11-16(12-10-15)22-19(23)17-7-5-6-8-18(17)26-22/h5-12H,3-4,13-14H2,1-2H3
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n/an/a 2.41E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46705
PNG
((4-chlorodithiazol-5-ylidene)-(3,4-dimethylphenyl)...)
Show SMILES Cc1ccc(cc1C)\N=c1\ssnc1Cl
Show InChI InChI=1S/C10H9ClN2S2/c1-6-3-4-8(5-7(6)2)12-10-9(11)13-15-14-10/h3-5H,1-2H3/b12-10+
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n/an/a 2.61E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46614
PNG
(2-(4-fluorophenyl)-6-nitro-4-(2,2,2-trifluoroethox...)
Show SMILES [O-][N+](=O)c1cc(OCC(F)(F)F)c2c(c1)sn(-c1ccc(F)cc1)c2=O
Show InChI InChI=1S/C15H8F4N2O4S/c16-8-1-3-9(4-2-8)20-14(22)13-11(25-7-15(17,18)19)5-10(21(23)24)6-12(13)26-20/h1-6H,7H2
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n/an/a 2.61E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46711
PNG
((4-chlorodithiazol-5-ylidene)-[3-(trifluoromethoxy...)
Show SMILES FC(F)(F)Oc1cccc(c1)\N=c1\ssnc1Cl
Show InChI InChI=1S/C9H4ClF3N2OS2/c10-7-8(17-18-15-7)14-5-2-1-3-6(4-5)16-9(11,12)13/h1-4H/b14-8+
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n/an/a 2.75E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46627
PNG
(2-(3-chloranyl-2-methyl-phenyl)-6-fluoranyl-1,2-be...)
Show SMILES Cc1c(Cl)cccc1-n1sc2cc(F)ccc2c1=O
Show InChI InChI=1S/C14H9ClFNOS/c1-8-11(15)3-2-4-12(8)17-14(18)10-6-5-9(16)7-13(10)19-17/h2-7H,1H3
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n/an/a 2.86E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46607
PNG
(5-(3,4-dimethoxyphenyl)-1,2-dihydro-1,2,4-triazole...)
Show SMILES COc1ccc(cc1OC)-c1n[nH]c(=S)[nH]1
Show InChI InChI=1S/C10H11N3O2S/c1-14-7-4-3-6(5-8(7)15-2)9-11-10(16)13-12-9/h3-5H,1-2H3,(H2,11,12,13,16)
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n/an/a 2.90E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46744
PNG
((4-chlorodithiazol-5-ylidene)-(6-methoxy-3-pyridyl...)
Show SMILES COc1ccc(cn1)\N=c1\ssnc1Cl
Show InChI InChI=1S/C8H6ClN3OS2/c1-13-6-3-2-5(4-10-6)11-8-7(9)12-15-14-8/h2-4H,1H3/b11-8+
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n/an/a 2.98E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
Mannose-6-phosphate isomerase


(Homo sapiens (Human))
BDBM46631
PNG
(2-(3-fluorophenyl)-4,6-dinitro-1,2-benzothiazol-3-...)
Show SMILES [O-][N+](=O)c1cc([N+]([O-])=O)c2c(c1)sn(-c1cccc(F)c1)c2=O
Show InChI InChI=1S/C13H6FN3O5S/c14-7-2-1-3-8(4-7)15-13(18)12-10(17(21)22)5-9(16(19)20)6-11(12)23-15/h1-6H
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n/an/a 3.01E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2J964TC
More data for this
Ligand-Target Pair
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