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Compile Data Set for Download or QSAR

Found 254 hits Enz. Inhib. hit(s) with all data for entry = 4266   
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, germ cell type


(Homo sapiens (Human))
BDBM39575
PNG
(MLS000031555 | N',N'-dimethyl-N-(4-quinazolinyl)et...)
Show SMILES CN(C)CCNc1ncnc2ccccc12
Show InChI InChI=1S/C12H16N4/c1-16(2)8-7-13-12-10-5-3-4-6-11(10)14-9-15-12/h3-6,9H,7-8H2,1-2H3,(H,13,14,15)
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39576
PNG
(1-(1-adamantyl)-3-[8-[[1-(2-furanylmethyl)-5-tetra...)
Show SMILES [H]C12CCC([H])(CC(C1)NC(=O)NC13CC4([H])CC([H])(CC([H])(C4)C1)C3)N2Cc1nnnn1Cc1ccco1 |TLB:17:18:24:15.14.23,THB:20:18:14:21.24.23,20:21:14:18.25.17|
Show InChI InChI=1S/C25H35N7O2/c33-24(27-25-11-16-6-17(12-25)8-18(7-16)13-25)26-19-9-20-3-4-21(10-19)31(20)15-23-28-29-30-32(23)14-22-2-1-5-34-22/h1-2,5,16-21H,3-4,6-15H2,(H2,26,27,33)
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39577
PNG
(1-[2-(3-Fluoro-phenyl)-5-methyl-pyrazolo[1,5-a]pyr...)
Show SMILES CCOC(=O)C1CCN(CC1)c1cc(C)nc2cc(nn12)-c1cccc(F)c1
Show InChI InChI=1S/C21H23FN4O2/c1-3-28-21(27)15-7-9-25(10-8-15)20-11-14(2)23-19-13-18(24-26(19)20)16-5-4-6-17(22)12-16/h4-6,11-13,15H,3,7-10H2,1-2H3
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM50247257
PNG
(CHEMBL474933 | cid_6398902 | triethylamine (E)-3-(...)
Show SMILES CN1C(=S)S\C(C1=O)=C1/C=Cc2ccccc2N1CCCS(O)(=O)=O |c:10|
Show InChI InChI=1S/C16H16N2O4S3/c1-17-15(19)14(24-16(17)23)13-8-7-11-5-2-3-6-12(11)18(13)9-4-10-25(20,21)22/h2-3,5-8H,4,9-10H2,1H3,(H,20,21,22)/b14-13+
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
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/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39578
PNG
(1-[1-[4-(2-furoyl)piperazine-1-carbonyl]cyclohexyl...)
Show SMILES O=C(Nc1ccccc1)NC1(CCCCC1)C(=O)N1CCN(CC1)C(=O)c1ccco1
Show InChI InChI=1S/C23H28N4O4/c28-20(19-10-7-17-31-19)26-13-15-27(16-14-26)21(29)23(11-5-2-6-12-23)25-22(30)24-18-8-3-1-4-9-18/h1,3-4,7-10,17H,2,5-6,11-16H2,(H2,24,25,30)
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n/an/an/an/a 3.56E+4n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39579
PNG
(5-Methyl-3-(2-propoxy-benzyl)-3H-benzooxazol-2-one...)
Show SMILES CCCOc1ccccc1Cn1c2cc(C)ccc2oc1=O
Show InChI InChI=1S/C18H19NO3/c1-3-10-21-16-7-5-4-6-14(16)12-19-15-11-13(2)8-9-17(15)22-18(19)20/h4-9,11H,3,10,12H2,1-2H3
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39580
PNG
(2-[1,3-benzodioxol-5-yl(2-thiophen-2-ylethanoyl)am...)
Show SMILES Cn1cccc1C(N(C(=O)Cc1cccs1)c1ccc2OCOc2c1)C(=O)NC1CCCCC1
Show InChI InChI=1S/C26H29N3O4S/c1-28-13-5-10-21(28)25(26(31)27-18-7-3-2-4-8-18)29(24(30)16-20-9-6-14-34-20)19-11-12-22-23(15-19)33-17-32-22/h5-6,9-15,18,25H,2-4,7-8,16-17H2,1H3,(H,27,31)
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39581
PNG
(6-Amino-4-(4-hydroxy-3-methoxy-phenyl)-3-propyl-1,...)
Show SMILES CCCc1[nH]nc2OC(=N)C(C#N)C(c12)c1ccc(O)c(OC)c1
Show InChI InChI=1S/C17H18N4O3/c1-3-4-11-15-14(9-5-6-12(22)13(7-9)23-2)10(8-18)16(19)24-17(15)21-20-11/h5-7,10,14,19,22H,3-4H2,1-2H3,(H,20,21)
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39582
PNG
((5-Benzo[1,3]dioxol-5-yl-1-methyl-1H-imidazol-2-yl...)
Show SMILES Cn1c(NCc2ccc(Cl)cc2)ncc1-c1ccc2OCOc2c1
Show InChI InChI=1S/C18H16ClN3O2/c1-22-15(13-4-7-16-17(8-13)24-11-23-16)10-21-18(22)20-9-12-2-5-14(19)6-3-12/h2-8,10H,9,11H2,1H3,(H,20,21)
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39583
PNG
(MLS000075623 | N-(5-Chloro-2-methoxy-phenyl)-2-[4-...)
Show SMILES COc1ccc(Cl)cc1NC(=O)CN1CCC(CC1)n1nnc2cc(C)ccc12
Show InChI InChI=1S/C21H24ClN5O2/c1-14-3-5-19-17(11-14)24-25-27(19)16-7-9-26(10-8-16)13-21(28)23-18-12-15(22)4-6-20(18)29-2/h3-6,11-12,16H,7-10,13H2,1-2H3,(H,23,28)
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM32012
PNG
(1-(3,4-Dihydroxy-phenyl)-2-(5-phenyl-4H-[1,2,4]tri...)
Show SMILES Oc1ccc(cc1O)C(=O)CSc1nnc([nH]1)-c1ccccc1
Show InChI InChI=1S/C16H13N3O3S/c20-12-7-6-11(8-13(12)21)14(22)9-23-16-17-15(18-19-16)10-4-2-1-3-5-10/h1-8,20-21H,9H2,(H,17,18,19)
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39584
PNG
(5,6-Dimethyl-2-[1-(1-thiophen-2-ylmethyl-1H-tetraz...)
Show SMILES Cc1cc2nc([nH]c2cc1C)C1CCN(Cc2nnnn2Cc2cccs2)CC1
Show InChI InChI=1S/C21H25N7S/c1-14-10-18-19(11-15(14)2)23-21(22-18)16-5-7-27(8-6-16)13-20-24-25-26-28(20)12-17-4-3-9-29-17/h3-4,9-11,16H,5-8,12-13H2,1-2H3,(H,22,23)
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39585
PNG
(5-(4-methoxyphenyl)-N-(2-pyridinylmethyl)-[1,2,4]t...)
Show SMILES COc1ccc(cc1)-c1cc(NCc2ccccn2)n2ncnc2n1
Show InChI InChI=1S/C18H16N6O/c1-25-15-7-5-13(6-8-15)16-10-17(24-18(23-16)21-12-22-24)20-11-14-4-2-3-9-19-14/h2-10,12,20H,11H2,1H3
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n/an/an/an/a 6.59E+4n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39586
PNG
((1-amino-7-benzyl-2,6,8,9-tetrahydropyrazolo[3,4-c...)
Show SMILES Nc1[nH]nc2nc(NCc3ccccc3)c3CN(Cc4ccccc4)CCc3c12
Show InChI InChI=1S/C23H24N6/c24-21-20-18-11-12-29(14-17-9-5-2-6-10-17)15-19(18)22(26-23(20)28-27-21)25-13-16-7-3-1-4-8-16/h1-10H,11-15H2,(H4,24,25,26,27,28)
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39587
PNG
(1-amino-3-isopropyl-3,4-dihydronaphthalene-2-carbo...)
Show SMILES CCOC(=O)C1=C(N)c2ccccc2CC1C(C)C |c:5|
Show InChI InChI=1S/C16H21NO2/c1-4-19-16(18)14-13(10(2)3)9-11-7-5-6-8-12(11)15(14)17/h5-8,10,13H,4,9,17H2,1-3H3
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39588
PNG
(MLS000038887 | N-[dimorpholin-4-ylphosphoryl(piper...)
Show SMILES O=NC(N1CCCCC1)P(=O)(N1CCOCC1)N1CCOCC1
Show InChI InChI=1S/C14H27N4O4P/c19-15-14(16-4-2-1-3-5-16)23(20,17-6-10-21-11-7-17)18-8-12-22-13-9-18/h14H,1-13H2
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n/an/an/an/a 5.45E+4n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
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/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39590
PNG
(3-(3-phenyl-10H-pyridazino[4,3-b]quinoxalin-5-yl)-...)
Show SMILES OCCCN1c2ccccc2Nc2nnc(cc12)-c1ccccc1
Show InChI InChI=1S/C19H18N4O/c24-12-6-11-23-17-10-5-4-9-15(17)20-19-18(23)13-16(21-22-19)14-7-2-1-3-8-14/h1-5,7-10,13,24H,6,11-12H2,(H,20,22)
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39591
PNG
(1-(3-benzyl-2-imino-benzimidazol-1-yl)-3-(4-methox...)
Show SMILES COc1ccc(OCC(O)Cn2c3ccccc3n(Cc3ccccc3)c2=N)cc1
Show InChI InChI=1S/C24H25N3O3/c1-29-20-11-13-21(14-12-20)30-17-19(28)16-27-23-10-6-5-9-22(23)26(24(27)25)15-18-7-3-2-4-8-18/h2-14,19,25,28H,15-17H2,1H3
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39592
PNG
(MLS000078483 | N-(2-furanylmethyl)-2-(6-methoxy-2-...)
Show SMILES COc1ccc2n(CC(=O)NCc3ccco3)c(C)cc(=O)c2c1
Show InChI InChI=1S/C18H18N2O4/c1-12-8-17(21)15-9-13(23-2)5-6-16(15)20(12)11-18(22)19-10-14-4-3-7-24-14/h3-9H,10-11H2,1-2H3,(H,19,22)
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39593
PNG
(6-(3-bromophenyl)-3-(3-methoxyphenyl)-7H-[1,2,4]tr...)
Show SMILES COc1cccc(c1)-c1nnc2SCC(=Nn12)c1cccc(Br)c1 |c:15|
Show InChI InChI=1S/C17H13BrN4OS/c1-23-14-7-3-5-12(9-14)16-19-20-17-22(16)21-15(10-24-17)11-4-2-6-13(18)8-11/h2-9H,10H2,1H3
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39594
PNG
(2-(5-bromo-4-methoxy-6-methyl-pyrimidin-2-yl)oxyac...)
Show SMILES COC(=O)COc1nc(C)c(Br)c(OC)n1
Show InChI InChI=1S/C9H11BrN2O4/c1-5-7(10)8(15-3)12-9(11-5)16-4-6(13)14-2/h4H2,1-3H3
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39595
PNG
(MLS000082269 | N,N-dimethyl-4-(1-propan-2-yl-2-ben...)
Show SMILES CC(C)n1c(nc2ccccc12)-c1ccc(cc1)N(C)C
Show InChI InChI=1S/C18H21N3/c1-13(2)21-17-8-6-5-7-16(17)19-18(21)14-9-11-15(12-10-14)20(3)4/h5-13H,1-4H3
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n/an/an/an/a 8.52E+3n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM34274
PNG
(1-(3,4-dihydroxyphenyl)-2-[[5-(2-methoxyphenyl)-4-...)
Show SMILES COc1ccccc1-c1nnc(SCC(=O)c2ccc(O)c(O)c2)n1CC=C
Show InChI InChI=1S/C20H19N3O4S/c1-3-10-23-19(14-6-4-5-7-18(14)27-2)21-22-20(23)28-12-17(26)13-8-9-15(24)16(25)11-13/h3-9,11,24-25H,1,10,12H2,2H3
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM34278
PNG
(1-(3,4-dihydroxyphenyl)-2-[[4-ethyl-5-(2-methoxyph...)
Show SMILES CCn1c(SCC(=O)c2ccc(O)c(O)c2)nnc1-c1ccccc1OC
Show InChI InChI=1S/C19H19N3O4S/c1-3-22-18(13-6-4-5-7-17(13)26-2)20-21-19(22)27-11-16(25)12-8-9-14(23)15(24)10-12/h4-10,23-24H,3,11H2,1-2H3
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39596
PNG
(2-[[4-ethyl-5-(2-methoxyphenyl)-1,2,4-triazol-3-yl...)
Show SMILES CCn1c(SCc2nc3ccccc3[nH]2)nnc1-c1ccccc1OC
Show InChI InChI=1S/C19H19N5OS/c1-3-24-18(13-8-4-7-11-16(13)25-2)22-23-19(24)26-12-17-20-14-9-5-6-10-15(14)21-17/h4-11H,3,12H2,1-2H3,(H,20,21)
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39597
PNG
((2-benzoxyphenyl)phosphonic acid | (2-phenylmethox...)
Show SMILES OP(O)(=O)c1ccccc1OCc1ccccc1
Show InChI InChI=1S/C13H13O4P/c14-18(15,16)13-9-5-4-8-12(13)17-10-11-6-2-1-3-7-11/h1-9H,10H2,(H2,14,15,16)
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39598
PNG
((5-methyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)-...)
Show SMILES Cc1cc(NCCCN2CCOCC2)n2ncc(-c3ccccc3)c2n1
Show InChI InChI=1S/C20H25N5O/c1-16-14-19(21-8-5-9-24-10-12-26-13-11-24)25-20(23-16)18(15-22-25)17-6-3-2-4-7-17/h2-4,6-7,14-15,21H,5,8-13H2,1H3
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39599
PNG
(MLS000056730 | N-(2-keto-4-methyl-chromen-7-yl)-2,...)
Show SMILES Cc1cc(=O)oc2cc(NC(=O)C3COc4ccccc4O3)ccc12
Show InChI InChI=1S/C19H15NO5/c1-11-8-18(21)25-16-9-12(6-7-13(11)16)20-19(22)17-10-23-14-4-2-3-5-15(14)24-17/h2-9,17H,10H2,1H3,(H,20,22)
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
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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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39601
PNG
(3-(4-chlorophenyl)sulfonyl-2-(2-furanyl)thiazolidi...)
Show SMILES Clc1ccc(cc1)S(=O)(=O)N1CCSC1c1ccco1
Show InChI InChI=1S/C13H12ClNO3S2/c14-10-3-5-11(6-4-10)20(16,17)15-7-9-19-13(15)12-2-1-8-18-12/h1-6,8,13H,7,9H2
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39602
PNG
(1-[1-[2-(4-fluorophenyl)ethyl]-2,5-dimethyl-3-pyrr...)
Show SMILES Cc1cc(C(=O)CSc2nnnn2C)c(C)n1CCc1ccc(F)cc1
Show InChI InChI=1S/C18H20FN5OS/c1-12-10-16(17(25)11-26-18-20-21-22-23(18)3)13(2)24(12)9-8-14-4-6-15(19)7-5-14/h4-7,10H,8-9,11H2,1-3H3
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39603
PNG
(2-[5-(4-chlorophenyl)-1,2,3,4-tetrazol-2-yl]-N-[2-...)
Show SMILES Clc1ccc(cc1)-c1nnn(CC(=O)NCCC2=CCCCC2)n1 |t:18|
Show InChI InChI=1S/C17H20ClN5O/c18-15-8-6-14(7-9-15)17-20-22-23(21-17)12-16(24)19-11-10-13-4-2-1-3-5-13/h4,6-9H,1-3,5,10-12H2,(H,19,24)
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39604
PNG
(2-[5-(4-chlorophenyl)-1,2,3,4-tetrazol-2-yl]-N-(cy...)
Show SMILES Clc1ccc(cc1)-c1nnn(CC(=O)NCC2CCCCC2)n1
Show InChI InChI=1S/C16H20ClN5O/c17-14-8-6-13(7-9-14)16-19-21-22(20-16)11-15(23)18-10-12-4-2-1-3-5-12/h6-9,12H,1-5,10-11H2,(H,18,23)
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39605
PNG
(5-[2-(2,4-dihydroxy-5-propyl-phenyl)-2-keto-ethyl]...)
Show SMILES CCCc1cc(C(=O)Cc2ccc(o2)C(=O)OCC)c(O)cc1O
Show InChI InChI=1S/C18H20O6/c1-3-5-11-8-13(16(21)10-14(11)19)15(20)9-12-6-7-17(24-12)18(22)23-4-2/h6-8,10,19,21H,3-5,9H2,1-2H3
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39606
PNG
(2,4-dimethyl-5-[1-oxo-2-[[5-(2-phenylpropyl)-1,3,4...)
Show SMILES CCOC(=O)c1c(C)[nH]c(C(=O)CSc2nnc(CC(C)c3ccccc3)o2)c1C
Show InChI InChI=1S/C22H25N3O4S/c1-5-28-21(27)19-14(3)20(23-15(19)4)17(26)12-30-22-25-24-18(29-22)11-13(2)16-9-7-6-8-10-16/h6-10,13,23H,5,11-12H2,1-4H3
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n/an/an/an/a 7.85E+4n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39607
PNG
(2-(5-bromanylfuran-2-yl)-5-(3,4-dimethoxyphenyl)-1...)
Show SMILES COc1ccc(cc1OC)-c1nnc(o1)-c1ccc(Br)o1
Show InChI InChI=1S/C14H11BrN2O4/c1-18-9-4-3-8(7-11(9)19-2)13-16-17-14(21-13)10-5-6-12(15)20-10/h3-7H,1-2H3
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n/an/an/an/a 2.59E+4n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39608
PNG
(1,3-benzodioxol-5-yl-(1-propyl-2-benzimidazolyl)me...)
Show SMILES CCCn1c(nc2ccccc12)C(O)c1ccc2OCOc2c1
Show InChI InChI=1S/C18H18N2O3/c1-2-9-20-14-6-4-3-5-13(14)19-18(20)17(21)12-7-8-15-16(10-12)23-11-22-15/h3-8,10,17,21H,2,9,11H2,1H3
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n/an/an/an/a 1.77E+4n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39609
PNG
(4-[1-(2,4-dimethylphenyl)-2,5-dimethyl-3-pyrrolyl]...)
Show SMILES Cc1cc(C2N=C(N)Nc3nc4ccccc4n23)c(C)n1-c1ccc(C)cc1C |t:5,(5.56,-1.7,;6.82,-.81,;6.83,.73,;8.3,1.19,;8.8,2.65,;10.37,2.97,;10.86,4.5,;12.37,4.82,;9.78,5.68,;8.22,5.32,;6.97,6.23,;5.73,5.32,;4.16,5.68,;3.08,4.5,;3.58,2.97,;5.15,2.65,;6.2,3.86,;7.74,3.86,;9.19,-.07,;10.73,-.08,;8.28,-1.3,;8.73,-2.77,;10.24,-3.11,;10.7,-4.58,;9.65,-5.71,;10.11,-7.18,;8.15,-5.37,;7.69,-3.9,;6.19,-3.57,)|
Show InChI InChI=1S/C23H24N6/c1-13-9-10-19(14(2)11-13)28-15(3)12-17(16(28)4)21-26-22(24)27-23-25-18-7-5-6-8-20(18)29(21)23/h5-12,21H,1-4H3,(H3,24,25,26,27)
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM34599
PNG
(1-[5-chloranyl-2-(trifluoromethyl)-1,3-benzodioxol...)
Show SMILES FC(F)(F)C1(NC(=O)Nc2cc(ncn2)N2CCOCC2)Oc2ccc(Cl)cc2O1
Show InChI InChI=1S/C17H15ClF3N5O4/c18-10-1-2-11-12(7-10)30-17(29-11,16(19,20)21)25-15(27)24-13-8-14(23-9-22-13)26-3-5-28-6-4-26/h1-2,7-9H,3-6H2,(H2,22,23,24,25,27)
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39610
PNG
(4-(1-azabicyclo[2.2.2]oct-2-ylmethyl)benzene-1,2-d...)
Show SMILES [H]C12CCN(CC1)C(Cc1ccc(O)c(O)c1)C2 |TLB:8:7:2.3:6.5,(7.09,2.4,;6.6,3.85,;2.76,2.16,;3.53,.83,;6.2,2.37,;9.02,1.2,;9.42,2.69,;4.69,5.16,;3.21,5.56,;2.81,7.05,;1.32,7.45,;.92,8.93,;2.01,10.02,;1.61,11.51,;3.5,9.62,;4.59,10.71,;3.9,8.14,;6.03,5.93,)|
Show InChI InChI=1S/C14H19NO2/c16-13-2-1-11(9-14(13)17)8-12-7-10-3-5-15(12)6-4-10/h1-2,9-10,12,16-17H,3-8H2
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39611
PNG
(1-(2-keto-2-pyrrolidino-ethyl)-3-phenyl-thieno[3,2...)
Show SMILES O=C(Cn1c2ccsc2c(=O)n(-c2ccccc2)c1=O)N1CCCC1
Show InChI InChI=1S/C18H17N3O3S/c22-15(19-9-4-5-10-19)12-20-14-8-11-25-16(14)17(23)21(18(20)24)13-6-2-1-3-7-13/h1-3,6-8,11H,4-5,9-10,12H2
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n/an/an/an/a 2.65E+3n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39612
PNG
(2-[2-(3,4-dihydroxyphenyl)-2-oxoethyl]sulfanyl-1H-...)
Show SMILES Oc1ccc(cc1O)C(=O)CSc1nc2ccccc2c(=O)[nH]1
Show InChI InChI=1S/C16H12N2O4S/c19-12-6-5-9(7-13(12)20)14(21)8-23-16-17-11-4-2-1-3-10(11)15(22)18-16/h1-7,19-20H,8H2,(H,17,18,22)
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
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/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM50309563
PNG
(2-(2-(3,4-dihydroxyphenyl)-2-oxoethylthio)-4-(meth...)
Show SMILES COCc1cc(C)nc(SCC(=O)c2ccc(O)c(O)c2)c1C#N
Show InChI InChI=1S/C17H16N2O4S/c1-10-5-12(8-23-2)13(7-18)17(19-10)24-9-16(22)11-3-4-14(20)15(21)6-11/h3-6,20-21H,8-9H2,1-2H3
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39613
PNG
(5-chloranyl-N-hexyl-thiophene-2-sulfonamide | 5-ch...)
Show SMILES CCCCCCNS(=O)(=O)c1ccc(Cl)s1
Show InChI InChI=1S/C10H16ClNO2S2/c1-2-3-4-5-8-12-16(13,14)10-7-6-9(11)15-10/h6-7,12H,2-5,8H2,1H3
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39614
PNG
(3-methyl-N,6-diphenyl-2-imidazo[2,1-b]thiazolecarb...)
Show SMILES Cc1c(sc2nc(cn12)-c1ccccc1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C19H15N3OS/c1-13-17(18(23)20-15-10-6-3-7-11-15)24-19-21-16(12-22(13)19)14-8-4-2-5-9-14/h2-12H,1H3,(H,20,23)
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39615
PNG
(MLS000087050 | N-(4-ethylphenyl)-5-(4-methoxypheny...)
Show SMILES CCc1ccc(NC(=O)c2cc(on2)-c2ccc(OC)cc2)cc1
Show InChI InChI=1S/C19H18N2O3/c1-3-13-4-8-15(9-5-13)20-19(22)17-12-18(24-21-17)14-6-10-16(23-2)11-7-14/h4-12H,3H2,1-2H3,(H,20,22)
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alkaline phosphatase, germ cell type


(Homo sapiens (Human))
BDBM39616
PNG
(1-[5-chloranyl-2-(trifluoromethyl)-1,3-benzodioxol...)
Show SMILES COCCNC(=O)NC1(Oc2ccc(Cl)cc2O1)C(F)(F)F
Show InChI InChI=1S/C12H12ClF3N2O4/c1-20-5-4-17-10(19)18-12(11(14,15)16)21-8-3-2-7(13)6-9(8)22-12/h2-3,6H,4-5H2,1H3,(H2,17,18,19)
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n/an/an/an/a 9.99E+5n/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 (2007)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
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