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PubChem AID 518

Compile data set for download or QSAR
Found 73 hits of Enzyme Inhibition Constant Data   
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
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM50299523
PNG
(2,5-Dimethoxy-N-(quinolin-3-yl)benzenesulfonamide ...)
Show SMILES COc1ccc(OC)c(c1)S(=O)(=O)Nc1cnc2ccccc2c1
Show InChI InChI=1S/C17H16N2O4S/c1-22-14-7-8-16(23-2)17(10-14)24(20,21)19-13-9-12-5-3-4-6-15(12)18-11-13/h3-11,19H,1-2H3
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n/an/a 150n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM39626
PNG
(2-(3-benzyl-1H-1,2,4-triazol-5-yl)-3a,4,7,7a-tetra...)
Show SMILES Oc1c2CC=CCc2c(O)n1-c1nnc(Cc2ccccc2)[nH]1
Show InChI InChI=1S/C17H16N4O2/c22-15-12-8-4-5-9-13(12)16(23)21(15)17-18-14(19-20-17)10-11-6-2-1-3-7-11/h1-7,22-23H,8-10H2,(H,18,19,20)
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n/an/a 330n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44418
PNG
(MLS000114796 | N-(3-propylsulfanyl-1H-1,2,4-triazo...)
Show SMILES CCCSc1nnc(NC(C)=O)[nH]1
Show InChI InChI=1S/C7H12N4OS/c1-3-4-13-7-9-6(10-11-7)8-5(2)12/h3-4H2,1-2H3,(H2,8,9,10,11,12)
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n/an/a 820n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM50254315
PNG
(3-(2-chlorophenyl)-1H-pyrazole-5-carboxylic acid |...)
Show SMILES OC(=O)c1cc(n[nH]1)-c1ccccc1Cl
Show InChI InChI=1S/C10H7ClN2O2/c11-7-4-2-1-3-6(7)8-5-9(10(14)15)13-12-8/h1-5H,(H,12,13)(H,14,15)
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n/an/a 980n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM41863
PNG
(3-(4-bromophenyl)-1H-pyrazole-5-carboxylic acid me...)
Show SMILES COC(=O)c1cc(n[nH]1)-c1ccc(Br)cc1
Show InChI InChI=1S/C11H9BrN2O2/c1-16-11(15)10-6-9(13-14-10)7-2-4-8(12)5-3-7/h2-6H,1H3,(H,13,14)
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n/an/a 1.14E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44413
PNG
((5E)-5-indol-3-ylidene-3-pyrazoline-3-carboxylic a...)
Show SMILES COC(=O)c1cc(n[nH]1)-c1c[nH]c2ccccc12
Show InChI InChI=1S/C13H11N3O2/c1-18-13(17)12-6-11(15-16-12)9-7-14-10-5-3-2-4-8(9)10/h2-7,14H,1H3,(H,15,16)
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n/an/a 1.17E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM41869
PNG
(4-methyl-3-phenyl-2H-pyrano[2,3-c]pyrazol-6-one | ...)
Show SMILES Cc1cc(=O)oc2n[nH]c(-c3ccccc3)c12
Show InChI InChI=1S/C13H10N2O2/c1-8-7-10(16)17-13-11(8)12(14-15-13)9-5-3-2-4-6-9/h2-7H,1H3,(H,14,15)
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n/an/a 1.23E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM41868
PNG
(3-phenyl-1H-pyrazole-5-carboxylic acid methyl este...)
Show SMILES COC(=O)c1cc(n[nH]1)-c1ccccc1
Show InChI InChI=1S/C11H10N2O2/c1-15-11(14)10-7-9(12-13-10)8-5-3-2-4-6-8/h2-7H,1H3,(H,12,13)
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n/an/a 1.24E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM50254317
PNG
(2,4-dihydrochromeno[4,3-c]pyrazole-3-carboxylic ac...)
Show SMILES OC(=O)c1[nH]nc-2c1COc1ccccc-21
Show InChI InChI=1S/C11H8N2O3/c14-11(15)10-7-5-16-8-4-2-1-3-6(8)9(7)12-13-10/h1-4H,5H2,(H,12,13)(H,14,15)
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n/an/a 1.29E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM41858
PNG
(3-(4-methoxyphenyl)-4-methyl-2H-pyrano[2,3-c]pyraz...)
Show SMILES COc1ccc(cc1)-c1[nH]nc2oc(=O)cc(C)c12
Show InChI InChI=1S/C14H12N2O3/c1-8-7-11(17)19-14-12(8)13(15-16-14)9-3-5-10(18-2)6-4-9/h3-7H,1-2H3,(H,15,16)
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n/an/a 1.35E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44387
PNG
(3-butyl-6,6-dimethyl-5,7-dihydro-1H-indazol-4-one ...)
Show SMILES CCCCc1[nH]nc2CC(C)(C)CC(=O)c12
Show InChI InChI=1S/C13H20N2O/c1-4-5-6-9-12-10(15-14-9)7-13(2,3)8-11(12)16/h4-8H2,1-3H3,(H,14,15)
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n/an/a 1.51E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44400
PNG
(MLS000098476 | N-(2-furfurylcarbamoyl)-2-[(5-pheny...)
Show SMILES O=C(CSc1nnc([nH]1)-c1ccccc1)NC(=O)NCc1ccco1
Show InChI InChI=1S/C16H15N5O3S/c22-13(18-15(23)17-9-12-7-4-8-24-12)10-25-16-19-14(20-21-16)11-5-2-1-3-6-11/h1-8H,9-10H2,(H,19,20,21)(H2,17,18,22,23)
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n/an/a 1.57E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44386
PNG
(5-[[2,5-dimethoxy-4-(1H-1,2,4-triazol-5-ylsulfanyl...)
Show SMILES COc1cc(CSc2nnc[nH]2)c(OC)cc1CSc1nnc[nH]1
Show InChI InChI=1S/C14H16N6O2S2/c1-21-11-3-10(6-24-14-16-8-18-20-14)12(22-2)4-9(11)5-23-13-15-7-17-19-13/h3-4,7-8H,5-6H2,1-2H3,(H,15,17,19)(H,16,18,20)
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n/an/a 1.66E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44411
PNG
(2-{2-[2-(2-phosphonophenoxy)ethoxy]ethoxy}phenylph...)
Show SMILES OP(O)(=O)c1ccccc1OCCOCCOc1ccccc1P(O)(O)=O
Show InChI InChI=1S/C16H20O9P2/c17-26(18,19)15-7-3-1-5-13(15)24-11-9-23-10-12-25-14-6-2-4-8-16(14)27(20,21)22/h1-8H,9-12H2,(H2,17,18,19)(H2,20,21,22)
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n/an/a 1.66E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44401
PNG
((E)-3-amino-2-[2-[[5-(2-bromophenyl)-1H-1,2,4-tria...)
Show SMILES CC(=N)C(C#N)C(=O)CSc1nnc([nH]1)-c1ccccc1Br
Show InChI InChI=1S/C14H12BrN5OS/c1-8(17)10(6-16)12(21)7-22-14-18-13(19-20-14)9-4-2-3-5-11(9)15/h2-5,10,17H,7H2,1H3,(H,18,19,20)
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n/an/a 1.73E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM50299537
PNG
(2-Methoxy-5-methyl-N-(pyridin-3-yl)benzenesulfonam...)
Show SMILES COc1ccc(C)cc1S(=O)(=O)Nc1cccnc1
Show InChI InChI=1S/C13H14N2O3S/c1-10-5-6-12(18-2)13(8-10)19(16,17)15-11-4-3-7-14-9-11/h3-9,15H,1-2H3
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n/an/a 1.78E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44422
PNG
(3-benzyl-6,6-dimethyl-5,7-dihydro-1H-indazol-4-one...)
Show SMILES CC1(C)Cc2n[nH]c(Cc3ccccc3)c2C(=O)C1
Show InChI InChI=1S/C16H18N2O/c1-16(2)9-13-15(14(19)10-16)12(17-18-13)8-11-6-4-3-5-7-11/h3-7H,8-10H2,1-2H3,(H,17,18)
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n/an/a 1.83E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM50299528
PNG
(2-ethoxy-5-methyl-N-(pyridin-3-yl)benzenesulfonami...)
Show SMILES CCOc1ccc(C)cc1S(=O)(=O)Nc1cccnc1
Show InChI InChI=1S/C14H16N2O3S/c1-3-19-13-7-6-11(2)9-14(13)20(17,18)16-12-5-4-8-15-10-12/h4-10,16H,3H2,1-2H3
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n/an/a 1.93E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44383
PNG
(MLS000034806 | N-[5-(2-Methoxy-phenyl)-4H-[1,2,4]t...)
Show SMILES COc1ccccc1-c1nnc(NC(C)=O)[nH]1
Show InChI InChI=1S/C11H12N4O2/c1-7(16)12-11-13-10(14-15-11)8-5-3-4-6-9(8)17-2/h3-6H,1-2H3,(H2,12,13,14,15,16)
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n/an/a 1.99E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44390
PNG
(2-N-phenyl-6-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulf...)
Show SMILES Nc1nc(CSc2nnc([nH]2)-c2ccccc2)nc(Nc2ccccc2)n1
Show InChI InChI=1S/C18H16N8S/c19-16-21-14(22-17(24-16)20-13-9-5-2-6-10-13)11-27-18-23-15(25-26-18)12-7-3-1-4-8-12/h1-10H,11H2,(H,23,25,26)(H3,19,20,21,22,24)
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n/an/a 2.02E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM40973
PNG
(2-{[5-(2-phosphonophenoxy)pentyl]oxy}phenylphospho...)
Show SMILES OP(O)(=O)c1ccccc1OCCCCCOc1ccccc1P(O)(O)=O
Show InChI InChI=1S/C17H22O8P2/c18-26(19,20)16-10-4-2-8-14(16)24-12-6-1-7-13-25-15-9-3-5-11-17(15)27(21,22)23/h2-5,8-11H,1,6-7,12-13H2,(H2,18,19,20)(H2,21,22,23)
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n/an/a 2.05E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44424
PNG
(3,4,5-trimethoxy-N-(5-phenyl-1H-pyrazol-3-yl)benza...)
Show SMILES COc1cc(cc(OC)c1OC)C(=O)Nc1cc(n[nH]1)-c1ccccc1
Show InChI InChI=1S/C19H19N3O4/c1-24-15-9-13(10-16(25-2)18(15)26-3)19(23)20-17-11-14(21-22-17)12-7-5-4-6-8-12/h4-11H,1-3H3,(H2,20,21,22,23)
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n/an/a 2.39E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44379
PNG
(5-(2-Chloro-phenyl)-3-phenyl-1H-[1,2,4]triazole | ...)
Show SMILES Clc1ccccc1-c1nnc([nH]1)-c1ccccc1
Show InChI InChI=1S/C14H10ClN3/c15-12-9-5-4-8-11(12)14-16-13(17-18-14)10-6-2-1-3-7-10/h1-9H,(H,16,17,18)
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n/an/a 2.47E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44399
PNG
(2-[[5-(2-bromophenyl)-1H-1,2,4-triazol-3-yl]sulfan...)
Show SMILES Brc1ccccc1-c1nnc(SCC(=O)NC(=O)NCc2ccco2)[nH]1
Show InChI InChI=1S/C16H14BrN5O3S/c17-12-6-2-1-5-11(12)14-20-16(22-21-14)26-9-13(23)19-15(24)18-8-10-4-3-7-25-10/h1-7H,8-9H2,(H,20,21,22)(H2,18,19,23,24)
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n/an/a 2.54E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44407
PNG
(7-methoxy-4,5-dihydro-1H-benzo[g]indazole-3-carbox...)
Show SMILES COc1ccc2-c3n[nH]c(C(O)=O)c3CCc2c1
Show InChI InChI=1S/C13H12N2O3/c1-18-8-3-5-9-7(6-8)2-4-10-11(9)14-15-12(10)13(16)17/h3,5-6H,2,4H2,1H3,(H,14,15)(H,16,17)
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n/an/a 2.62E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44423
PNG
(3-(4-chlorophenyl)-1H-pyrazole-5-carboxylic acid |...)
Show SMILES OC(=O)c1cc(n[nH]1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C10H7ClN2O2/c11-7-3-1-6(2-4-7)8-5-9(10(14)15)13-12-8/h1-5H,(H,12,13)(H,14,15)
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n/an/a 2.67E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM41867
PNG
(5-(1-naphthalenyl)-1,2-dihydropyrazol-3-one | 5-(1...)
Show SMILES O=c1cc([nH][nH]1)-c1cccc2ccccc12
Show InChI InChI=1S/C13H10N2O/c16-13-8-12(14-15-13)11-7-3-5-9-4-1-2-6-10(9)11/h1-8H,(H2,14,15,16)
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n/an/a 3.24E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM42622
PNG
(3-phenyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazole |...)
Show SMILES C1Cc2[nH]nc(c2C1)-c1ccccc1
Show InChI InChI=1S/C12H12N2/c1-2-5-9(6-3-1)12-10-7-4-8-11(10)13-14-12/h1-3,5-6H,4,7-8H2,(H,13,14)
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n/an/a 3.40E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44405
PNG
(6,6-dimethyl-3-(2-thienyl)-5,7-dihydro-1H-indazol-...)
Show SMILES CC1(C)Cc2[nH]nc(-c3cccs3)c2C(=O)C1
Show InChI InChI=1S/C13H14N2OS/c1-13(2)6-8-11(9(16)7-13)12(15-14-8)10-4-3-5-17-10/h3-5H,6-7H2,1-2H3,(H,14,15)
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n/an/a 3.67E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM42696
PNG
(3-phenyl-1H-indazole | MLS000095818 | SMR000031366...)
Show SMILES c1ccc(cc1)-c1n[nH]c2ccccc12
Show InChI InChI=1S/C13H10N2/c1-2-6-10(7-3-1)13-11-8-4-5-9-12(11)14-15-13/h1-9H,(H,14,15)
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n/an/a 3.72E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44389
PNG
(2-[[5-(2-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulf...)
Show SMILES COc1ccccc1-c1nnc(SCc2ccccn2)[nH]1
Show InChI InChI=1S/C15H14N4OS/c1-20-13-8-3-2-7-12(13)14-17-15(19-18-14)21-10-11-6-4-5-9-16-11/h2-9H,10H2,1H3,(H,17,18,19)
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n/an/a 3.79E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44388
PNG
(5-(2-furanyl)-2-(4-methoxyphenyl)-5,6-dihydro-[1,2...)
Show SMILES COc1ccc(cc1)-c1nc2SC(CC(=O)n2n1)c1ccco1
Show InChI InChI=1S/C16H13N3O3S/c1-21-11-6-4-10(5-7-11)15-17-16-19(18-15)14(20)9-13(23-16)12-3-2-8-22-12/h2-8,13H,9H2,1H3
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n/an/a 3.82E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44398
PNG
(2-oxo-4-propan-2-yl-4,10-dihydro-3H-pyrimido[1,2-a...)
Show SMILES CCOC(=O)C1C(C(C)C)n2c(NC1=O)nc1ccccc21
Show InChI InChI=1S/C16H19N3O3/c1-4-22-15(21)12-13(9(2)3)19-11-8-6-5-7-10(11)17-16(19)18-14(12)20/h5-9,12-13H,4H2,1-3H3,(H,17,18,20)
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n/an/a 3.94E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44412
PNG
(3-(allylthio)-5-(4-methoxyphenyl)-1H-1,2,4-triazol...)
Show SMILES COc1ccc(cc1)-c1nnc(SCC=C)[nH]1
Show InChI InChI=1S/C12H13N3OS/c1-3-8-17-12-13-11(14-15-12)9-4-6-10(16-2)7-5-9/h3-7H,1,8H2,2H3,(H,13,14,15)
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n/an/a 4.35E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM34370
PNG
(4-[2-[2-(3,4-dihydroxyphenyl)-2-oxoethyl]sulfanyl-...)
Show SMILES Oc1ccc(cc1O)C(=O)CSc1nc2ccccc2c(=O)n1CCCC(=O)NCC1CCCO1
Show InChI InChI=1S/C25H27N3O6S/c29-20-10-9-16(13-21(20)30)22(31)15-35-25-27-19-7-2-1-6-18(19)24(33)28(25)11-3-8-23(32)26-14-17-5-4-12-34-17/h1-2,6-7,9-10,13,17,29-30H,3-5,8,11-12,14-15H2,(H,26,32)
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n/an/a 4.66E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44397
PNG
(1-(2,5-dimethoxyphenyl)-2-(1H-imidazo[4,5-b]pyridi...)
Show SMILES COc1ccc(OC)c(c1)C(=O)CSc1nc2ncccc2[nH]1
Show InChI InChI=1S/C16H15N3O3S/c1-21-10-5-6-14(22-2)11(8-10)13(20)9-23-16-18-12-4-3-7-17-15(12)19-16/h3-8H,9H2,1-2H3,(H,17,18,19)
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n/an/a 4.68E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM4303
PNG
((2E)-2-cyano-3-(3,4-dihydroxyphenyl)-N-(3-phenylpr...)
Show SMILES Oc1ccc(\C=C(/C#N)C(=O)NCCCc2ccccc2)cc1O
Show InChI InChI=1S/C19H18N2O3/c20-13-16(11-15-8-9-17(22)18(23)12-15)19(24)21-10-4-7-14-5-2-1-3-6-14/h1-3,5-6,8-9,11-12,22-23H,4,7,10H2,(H,21,24)/b16-11+
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n/an/a 5.16E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM34565
PNG
(6-Amino-4-(4-hydroxy-3,5-dimethoxy-phenyl)-3-metho...)
Show SMILES COCc1n[nH]c2OC(=N)C(C#N)C(c12)c1cc(OC)c(O)c(OC)c1
Show InChI InChI=1S/C17H18N4O5/c1-23-7-10-14-13(9(6-18)16(19)26-17(14)21-20-10)8-4-11(24-2)15(22)12(5-8)25-3/h4-5,9,13,19,22H,7H2,1-3H3,(H,20,21)
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n/an/a 5.25E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44385
PNG
(5-Chloro-1-phenyl-1,3-dihydro-benzoimidazol-2-one ...)
Show SMILES Clc1ccc2n(-c3ccccc3)c(=O)[nH]c2c1
Show InChI InChI=1S/C13H9ClN2O/c14-9-6-7-12-11(8-9)15-13(17)16(12)10-4-2-1-3-5-10/h1-8H,(H,15,17)
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n/an/a 5.34E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM34277
PNG
(4-cyano-3-methyl-5-[[1-oxo-2-[(5-phenyl-1H-1,2,4-t...)
Show SMILES CCOC(=O)c1sc(NC(=O)CSc2nnc([nH]2)-c2ccccc2)c(C#N)c1C
Show InChI InChI=1S/C19H17N5O3S2/c1-3-27-18(26)15-11(2)13(9-20)17(29-15)21-14(25)10-28-19-22-16(23-24-19)12-7-5-4-6-8-12/h4-8H,3,10H2,1-2H3,(H,21,25)(H,22,23,24)
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n/an/a 5.39E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44382
PNG
(3-(2-Chloro-phenyl)-7-methyl-7H-pyrazolo[4,3-e][1,...)
Show SMILES Cn1ncc2c1ncn1c(nnc21)-c1ccccc1Cl
Show InChI InChI=1S/C13H9ClN6/c1-19-11-9(6-16-19)13-18-17-12(20(13)7-15-11)8-4-2-3-5-10(8)14/h2-7H,1H3
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n/an/a 5.83E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44396
PNG
(1-(4-fluorophenyl)-2-(1H-imidazo[4,5-b]pyridin-2-y...)
Show SMILES Fc1ccc(cc1)C(=O)CSc1nc2ncccc2[nH]1
Show InChI InChI=1S/C14H10FN3OS/c15-10-5-3-9(4-6-10)12(19)8-20-14-17-11-2-1-7-16-13(11)18-14/h1-7H,8H2,(H,16,17,18)
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n/an/a 6.26E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44384
PNG
(5-(4-Bromo-phenyl)-4-chloro-2H-pyrazol-3-ylamine |...)
Show SMILES Nc1[nH]nc(c1Cl)-c1ccc(Br)cc1
Show InChI InChI=1S/C9H7BrClN3/c10-6-3-1-5(2-4-6)8-7(11)9(12)14-13-8/h1-4H,(H3,12,13,14)
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n/an/a 6.51E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44414
PNG
(3-[(2,6-dimethylphenoxy)methyl]-7-methyl-7H-pyrazo...)
Show SMILES Cc1cccc(C)c1OCc1nnc2c3cnn(C)c3ncn12
Show InChI InChI=1S/C16H16N6O/c1-10-5-4-6-11(2)14(10)23-8-13-19-20-16-12-7-18-21(3)15(12)17-9-22(13)16/h4-7,9H,8H2,1-3H3
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n/an/a 6.89E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44392
PNG
(MLS000082333 | SMR000044745 | cid_663917)
Show SMILES Cc1nnc2c3cnn(-c4ccc(C)c(C)c4)c3ncn12
Show InChI InChI=1S/C15H14N6/c1-9-4-5-12(6-10(9)2)21-14-13(7-17-21)15-19-18-11(3)20(15)8-16-14/h4-8H,1-3H3
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n/an/a 7.92E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM34465
PNG
(2,5-dimethoxy-N-[4-oxidanyl-3-(1H-1,2,4-triazol-5-...)
Show SMILES COc1ccc(OC)c(c1)S(=O)(=O)Nc1ccc(O)c(Sc2nnc[nH]2)c1
Show InChI InChI=1S/C16H16N4O5S2/c1-24-11-4-6-13(25-2)15(8-11)27(22,23)20-10-3-5-12(21)14(7-10)26-16-17-9-18-19-16/h3-9,20-21H,1-2H3,(H,17,18,19)
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n/an/a 8.45E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM42669
PNG
(1H-indazole-3-carboxylic acid [2-[(5-methyl-3-isox...)
Show SMILES Cc1cc(NC(=O)COC(=O)c2n[nH]c3ccccc23)no1
Show InChI InChI=1S/C14H12N4O4/c1-8-6-11(18-22-8)15-12(19)7-21-14(20)13-9-4-2-3-5-10(9)16-17-13/h2-6H,7H2,1H3,(H,16,17)(H,15,18,19)
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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
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM39589
PNG
(MLS000069150 | SMR000039131 | cid_6603438)
Show SMILES Cl.CC1(C)Cc2c(CO1)sc1nc3CCCCCn3c(=N)c21
Show InChI InChI=1S/C16H21N3OS.ClH/c1-16(2)8-10-11(9-20-16)21-15-13(10)14(17)19-7-5-3-4-6-12(19)18-15;/h17H,3-9H2,1-2H3;1H/b17-14-;
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n/an/a 9.50E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44380
PNG
(3-(1-methyl-2-pyrrolyl)-1H-pyrazole-5-carboxylic a...)
Show SMILES Cn1cccc1-c1cc([nH]n1)C(O)=O
Show InChI InChI=1S/C9H9N3O2/c1-12-4-2-3-8(12)6-5-7(9(13)14)11-10-6/h2-5H,1H3,(H,10,11)(H,13,14)
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n/an/a 1.02E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM34392
PNG
(5-[2-(3,4-dihydroxyphenyl)-2-oxoethyl]sulfanyl-2-p...)
Show SMILES CC(C)C1N=C2N(C1=O)C(SCC(=O)c1ccc(O)c(O)c1)=Nc1ccccc21
Show InChI InChI=1S/C21H19N3O4S/c1-11(2)18-20(28)24-19(23-18)13-5-3-4-6-14(13)22-21(24)29-10-17(27)12-7-8-15(25)16(26)9-12/h3-9,11,18,25-26H,10H2,1-2H3
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n/an/a 1.03E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM41414
PNG
(5-[(3-methyl-2-thienyl)methylene][1,3]thiazolo[3,2...)
Show SMILES Cc1ccsc1C=c1sc2ncnn2c1=O
Show InChI InChI=1S/C10H7N3OS2/c1-6-2-3-15-7(6)4-8-9(14)13-10(16-8)11-5-12-13/h2-5H,1H3
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n/an/a 1.17E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44395
PNG
(MLS000041697 | SMR000045758 | cid_664733)
Show SMILES Cc1nc2c3cnn(-c4ccc(C)c(C)c4)c3ncn2n1
Show InChI InChI=1S/C15H14N6/c1-9-4-5-12(6-10(9)2)21-14-13(7-17-21)15-18-11(3)19-20(15)8-16-14/h4-8H,1-3H3
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n/an/a 1.29E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44393
PNG
(MLS000040759 | SMR000044955 | cid_664061)
Show SMILES Cn1ncc2c1ncn1nc(CCc3ccccc3)nc21
Show InChI InChI=1S/C15H14N6/c1-20-14-12(9-17-20)15-18-13(19-21(15)10-16-14)8-7-11-5-3-2-4-6-11/h2-6,9-10H,7-8H2,1H3
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n/an/a 1.58E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44409
PNG
(1-(2-fluorophenyl)-4-{[4-(1H-pyrrol-1-yl)phenyl]ac...)
Show SMILES Fc1ccccc1N1CCN(CC1)C(=O)Cc1ccc(cc1)-n1cccc1
Show InChI InChI=1S/C22H22FN3O/c23-20-5-1-2-6-21(20)25-13-15-26(16-14-25)22(27)17-18-7-9-19(10-8-18)24-11-3-4-12-24/h1-12H,13-17H2
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n/an/a>1.00E+5n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44419
PNG
(1-[3-(2-fluorobenzyl)hexahydropyrimidin-1-yl]-2-(8...)
Show SMILES Cc1ccc2OCc3cnn(CC(=O)N4CCCN(Cc5ccccc5F)C4)c3-c2c1
Show InChI InChI=1S/C24H25FN4O2/c1-17-7-8-22-20(11-17)24-19(15-31-22)12-26-29(24)14-23(30)28-10-4-9-27(16-28)13-18-5-2-3-6-21(18)25/h2-3,5-8,11-12H,4,9-10,13-16H2,1H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44394
PNG
(MLS000083263 | SMR000045098 | cid_664143)
Show SMILES CCCc1nc2c3cnn(-c4cccc(Cl)c4)c3ncn2n1
Show InChI InChI=1S/C15H13ClN6/c1-2-4-13-19-15-12-8-18-22(11-6-3-5-10(16)7-11)14(12)17-9-21(15)20-13/h3,5-9H,2,4H2,1H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44417
PNG
(1-(1,3-benzodioxol-5-yl)-N-[[3-(4-bromophenyl)-6-t...)
Show SMILES Brc1ccc(cc1)-c1nnc2sc(CNCc3ccc4OCOc4c3)cn12
Show InChI InChI=1S/C19H15BrN4O2S/c20-14-4-2-13(3-5-14)18-22-23-19-24(18)10-15(27-19)9-21-8-12-1-6-16-17(7-12)26-11-25-16/h1-7,10,21H,8-9,11H2
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n/an/a>1.00E+5n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44420
PNG
(1-[2-(1-ethyl-4-keto-thieno[3,4]pyrrolo[3,5-c][1,2...)
Show SMILES CCOC(=O)C1CCCN(C1)C(=O)Cn1nc(CC)n2c3ccsc3cc2c1=O
Show InChI InChI=1S/C20H24N4O4S/c1-3-17-21-23(19(26)15-10-16-14(24(15)17)7-9-29-16)12-18(25)22-8-5-6-13(11-22)20(27)28-4-2/h7,9-10,13H,3-6,8,11-12H2,1-2H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44381
PNG
(MLS000027331 | N-(4-Azepan-1-yl-phenyl)-2-(5-oxo-3...)
Show SMILES O=C(Cn1c(noc1=O)-c1ccccc1)Nc1ccc(cc1)N1CCCCCC1
Show InChI InChI=1S/C22H24N4O3/c27-20(16-26-21(24-29-22(26)28)17-8-4-3-5-9-17)23-18-10-12-19(13-11-18)25-14-6-1-2-7-15-25/h3-5,8-13H,1-2,6-7,14-16H2,(H,23,27)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44415
PNG
(MLS000065061 | N-(3-cyclohexyl-1H-1,2,4-triazol-5-...)
Show SMILES O=C(Nc1nnc([nH]1)C1CCCCC1)C1CCCCC1
Show InChI InChI=1S/C15H24N4O/c20-14(12-9-5-2-6-10-12)17-15-16-13(18-19-15)11-7-3-1-4-8-11/h11-12H,1-10H2,(H2,16,17,18,19,20)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44410
PNG
((4-benzylpiperazin-1-yl)-[1-(1,4-dioxa-8-azaspiro[...)
Show SMILES O=C(C1CCN(CC1)S(=O)(=O)N1CCC2(CC1)OCCO2)N1CCN(Cc2ccccc2)CC1
Show InChI InChI=1S/C24H36N4O5S/c29-23(26-16-14-25(15-17-26)20-21-4-2-1-3-5-21)22-6-10-27(11-7-22)34(30,31)28-12-8-24(9-13-28)32-18-19-33-24/h1-5,22H,6-20H2
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n/an/a>1.00E+5n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44408
PNG
(2-({4-(4-methylphenyl)-5-[(1-methyl-1H-pyrrol-2-yl...)
Show SMILES Cc1nnc(NC(=O)CSc2nnc(Cc3cccn3C)n2-c2ccc(C)cc2)s1
Show InChI InChI=1S/C20H21N7OS2/c1-13-6-8-15(9-7-13)27-17(11-16-5-4-10-26(16)3)23-25-20(27)29-12-18(28)21-19-24-22-14(2)30-19/h4-10H,11-12H2,1-3H3,(H,21,24,28)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM41242
PNG
(MLS000047147 | N-[1-[(4-methoxyphenyl)methylamino]...)
Show SMILES COc1ccc(CNC(=O)C(C)NC(=O)c2cc3ccccc3o2)cc1
Show InChI InChI=1S/C20H20N2O4/c1-13(19(23)21-12-14-7-9-16(25-2)10-8-14)22-20(24)18-11-15-5-3-4-6-17(15)26-18/h3-11,13H,12H2,1-2H3,(H,21,23)(H,22,24)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44416
PNG
(2-{5-[(2-bromo-4-ethylphenoxy)methyl]-1,2,4-oxadia...)
Show SMILES CCc1ccc(OCc2nc(no2)-c2ccccn2)c(Br)c1
Show InChI InChI=1S/C16H14BrN3O2/c1-2-11-6-7-14(12(17)9-11)21-10-15-19-16(20-22-15)13-5-3-4-8-18-13/h3-9H,2,10H2,1H3
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44402
PNG
(MLS000096194 | N-[2-(dimethylamino)ethyl]-2-(6-ket...)
Show SMILES CN(C)CCNC(=O)Cn1nc(ccc1=O)-c1ccccc1
Show InChI InChI=1S/C16H20N4O2/c1-19(2)11-10-17-15(21)12-20-16(22)9-8-14(18-20)13-6-4-3-5-7-13/h3-9H,10-12H2,1-2H3,(H,17,21)
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM39600
PNG
(MLS000048783 | SMR000061847 | cid_943085)
Show SMILES c1nn(-c2ccccc2)c2ncn3cnnc3c12
Show InChI InChI=1S/C12H8N6/c1-2-4-9(5-3-1)18-11-10(6-15-18)12-16-14-8-17(12)7-13-11/h1-8H
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44406
PNG
(4-[5-[(2-methoxyphenyl)sulfonylmethyl]-2-furoyl]pi...)
Show SMILES CCOC(=O)N1CCN(CC1)C(=O)c1ccc(CS(=O)(=O)c2ccccc2OC)o1
Show InChI InChI=1S/C20H24N2O7S/c1-3-28-20(24)22-12-10-21(11-13-22)19(23)17-9-8-15(29-17)14-30(25,26)18-7-5-4-6-16(18)27-2/h4-9H,3,10-14H2,1-2H3
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44421
PNG
(MLS000103608 | N-(1,3-dimethyl-2,6-dioxo-4-pyrimid...)
Show SMILES Cn1c(NC(=O)CC(C)(C)C)cc(=O)n(C)c1=O
Show InChI InChI=1S/C12H19N3O3/c1-12(2,3)7-9(16)13-8-6-10(17)15(5)11(18)14(8)4/h6H,7H2,1-5H3,(H,13,16)
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44391
PNG
(2-(2-bromophenyl)-5-(2-furanylmethylidene)-6-thiaz...)
Show SMILES Brc1ccccc1-c1nc2sc(=Cc3ccco3)c(=O)n2n1
Show InChI InChI=1S/C15H8BrN3O2S/c16-11-6-2-1-5-10(11)13-17-15-19(18-13)14(20)12(22-15)8-9-4-3-7-21-9/h1-8H
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44403
PNG
(MLS000092367 | N,N-diethyl-1-methyl-3-(morpholin-4...)
Show SMILES CCN(CC)S(=O)(=O)c1ccc2n(C)cc(C(=O)N3CCOCC3)c(=O)c2c1
Show InChI InChI=1S/C19H25N3O5S/c1-4-22(5-2)28(25,26)14-6-7-17-15(12-14)18(23)16(13-20(17)3)19(24)21-8-10-27-11-9-21/h6-7,12-13H,4-5,8-11H2,1-3H3
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM32272
PNG
(MLS000119995 | N-butyl-2,3-bis(2-furanyl)-6-quinox...)
Show SMILES CCCCNC(=O)c1ccc2nc(-c3ccco3)c(nc2c1)-c1ccco1
Show InChI InChI=1S/C21H19N3O3/c1-2-3-10-22-21(25)14-8-9-15-16(13-14)24-20(18-7-5-12-27-18)19(23-15)17-6-4-11-26-17/h4-9,11-13H,2-3,10H2,1H3,(H,22,25)
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM41417
PNG
(MLS000116423 | N-(5-methyl-2-phenyl-3-pyrazolyl)-4...)
Show SMILES Cc1cc(NC(=O)c2noc-3c2CCc2ccccc-32)n(n1)-c1ccccc1
Show InChI InChI=1S/C22H18N4O2/c1-14-13-19(26(24-14)16-8-3-2-4-9-16)23-22(27)20-18-12-11-15-7-5-6-10-17(15)21(18)28-25-20/h2-10,13H,11-12H2,1H3,(H,23,27)
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM44404
PNG
(MLS000090420 | SMR000025030 | [5-(hydroxymethyl)-1...)
Show SMILES OCc1nnn(c1CO)-c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C11H10F3N3O2/c12-11(13,14)7-2-1-3-8(4-7)17-10(6-19)9(5-18)15-16-17/h1-4,18-19H,5-6H2
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n/an/a>1.00E+5n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2SX6BMJ
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%