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PubChem AID 696

Compile Data Set for Download or QSAR

Found 254 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 placental-like


(Homo sapiens)
BDBM39576
PNG
(1-(1-adamantyl)-3-[8-[[1-(2-furanylmethyl)-5-tetra...)
Show SMILES O=C(NC1CC2CCC(C1)N2Cc1nnnn1Cc1ccco1)NC12CC3CC(CC(C3)C1)C2
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 placental-like


(Homo sapiens)
BDBM50247257
PNG
(CHEMBL474933 | cid_6398902 | triethylamine (E)-3-(...)
Show SMILES CN1C(=S)S\C(C1=O)=C1/C=Cc2ccccc2N1CCCS(O)(=O)=O
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 placental-like


(Homo sapiens)
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 placental-like


(Homo sapiens)
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 placental-like


(Homo sapiens)
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 placental-like


(Homo sapiens)
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 placental-like


(Homo sapiens)
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 placental-like


(Homo sapiens)
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 placental-like


(Homo sapiens)
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 placental-like


(Homo sapiens)
BDBM32099
PNG
(MLS000044274 | N-[5-chloranyl-2-(trifluoromethyl)-...)
Show SMILES FC(F)(F)C1(NC(=O)N2CCC3(CC2)OCCO3)Oc2ccc(Cl)cc2O1
Show InChI InChI=1S/C16H16ClF3N2O5/c17-10-1-2-11-12(9-10)27-16(26-11,15(18,19)20)21-13(23)22-5-3-14(4-6-22)24-7-8-25-14/h1-2,9H,3-8H2,(H,21,23)
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n/an/an/an/a 6.19E+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 placental-like


(Homo sapiens)
BDBM39623
PNG
(6-[(2-ethoxyphenoxy)methyl]-3-(4-methylphenyl)-[1,...)
Show SMILES CCOc1ccccc1OCc1nn2c(nnc2s1)-c1ccc(C)cc1
Show InChI InChI=1S/C19H18N4O2S/c1-3-24-15-6-4-5-7-16(15)25-12-17-22-23-18(20-21-19(23)26-17)14-10-8-13(2)9-11-14/h4-11H,3,12H2,1-2H3
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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 placental-like


(Homo sapiens)
BDBM37169
PNG
((4-bromophenyl)-[(1-propylbenzimidazol-2-yl)methyl...)
Show SMILES CCCn1c(CNc2ccc(Br)cc2)nc2ccccc12
Show InChI InChI=1S/C17H18BrN3/c1-2-11-21-16-6-4-3-5-15(16)20-17(21)12-19-14-9-7-13(18)8-10-14/h3-10,19H,2,11-12H2,1H3
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n/an/an/an/a 4.85E+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 placental-like


(Homo sapiens)
BDBM39632
PNG
(5-amino-N-(3-methoxyphenyl)-1-(2-phenylethyl)-4-tr...)
Show SMILES COc1cccc(NC(=O)c2nnn(CCc3ccccc3)c2N)c1
Show InChI InChI=1S/C18H19N5O2/c1-25-15-9-5-8-14(12-15)20-18(24)16-17(19)23(22-21-16)11-10-13-6-3-2-4-7-13/h2-9,12H,10-11,19H2,1H3,(H,20,24)
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n/an/an/an/a 8.28E+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 placental-like


(Homo sapiens)
BDBM39633
PNG
(1-[5-chloranyl-2-(trifluoromethyl)-1,3-benzodioxol...)
Show SMILES FC(F)(F)C1(NC(=O)NCc2cccnc2)Oc2ccc(Cl)cc2O1
Show InChI InChI=1S/C15H11ClF3N3O3/c16-10-3-4-11-12(6-10)25-15(24-11,14(17,18)19)22-13(23)21-8-9-2-1-5-20-7-9/h1-7H,8H2,(H2,21,22,23)
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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 placental-like


(Homo sapiens)
BDBM39634
PNG
(4-fluoranyl-N-[2-(4-methylphenyl)sulfanylethyl]ben...)
Show SMILES Cc1ccc(SCCNS(=O)(=O)c2ccc(F)cc2)cc1
Show InChI InChI=1S/C15H16FNO2S2/c1-12-2-6-14(7-3-12)20-11-10-17-21(18,19)15-8-4-13(16)5-9-15/h2-9,17H,10-11H2,1H3
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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 placental-like


(Homo sapiens)
BDBM39641
PNG
(1-allyl-3a,8b-dihydroxy-3H-inden[1,2-d]imidazole-2...)
Show SMILES OC12NC(=O)N(CC=C)C1(O)c1ccccc1C2=O
Show InChI InChI=1S/C13H12N2O4/c1-2-7-15-11(17)14-12(18)10(16)8-5-3-4-6-9(8)13(12,15)19/h2-6,18-19H,1,7H2,(H,14,17)
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n/an/an/an/a 9.99E+5n/an/an/an/a



Burnham Center for Chemical Genomics

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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 placental-like


(Homo sapiens)
BDBM39660
PNG
(1-(1,3-benzodioxol-5-yl)-5-[(2,4-dichlorobenzyl)th...)
Show SMILES Clc1ccc(CSc2nnnn2-c2ccc3OCOc3c2)c(Cl)c1
Show InChI InChI=1S/C15H10Cl2N4O2S/c16-10-2-1-9(12(17)5-10)7-24-15-18-19-20-21(15)11-3-4-13-14(6-11)23-8-22-13/h1-6H,7-8H2
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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 placental-like


(Homo sapiens)
BDBM39666
PNG
(2-[4-(4-fluorobenzoyl)phenyl]-2-(4-methylphenyl)ac...)
Show SMILES Cc1ccc(cc1)C(C#N)c1ccc(cc1)C(=O)c1ccc(F)cc1
Show InChI InChI=1S/C22H16FNO/c1-15-2-4-16(5-3-15)21(14-24)17-6-8-18(9-7-17)22(25)19-10-12-20(23)13-11-19/h2-13,21H,1H3
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n/an/an/an/a 9.99E+5n/an/an/an/a



Burnham Center for Chemical Genomics

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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 placental-like


(Homo sapiens)
BDBM39677
PNG
(7-(2-furanylmethyl)-N-[3-(1-imidazolyl)propyl]-5,6...)
Show SMILES C(CNc1ncnc2n(Cc3ccco3)c(c(-c3ccccc3)c12)-c1ccccc1)Cn1ccnc1
Show InChI InChI=1S/C29H26N6O/c1-3-9-22(10-4-1)25-26-28(31-14-8-16-34-17-15-30-21-34)32-20-33-29(26)35(19-24-13-7-18-36-24)27(25)23-11-5-2-6-12-23/h1-7,9-13,15,17-18,20-21H,8,14,16,19H2,(H,31,32,33)
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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 placental-like


(Homo sapiens)
BDBM32278
PNG
((6-anilino-2-pyridyl)-phenyl-amine | 2-N,6-N-diphe...)
Show SMILES N(c1ccccc1)c1cccc(Nc2ccccc2)n1
Show InChI InChI=1S/C17H15N3/c1-3-8-14(9-4-1)18-16-12-7-13-17(20-16)19-15-10-5-2-6-11-15/h1-13H,(H2,18,19,20)
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n/an/an/an/a 3.70E+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 placental-like


(Homo sapiens)
BDBM39702
PNG
(4-[[(3,4-diketo-2-piperidino-cyclobuten-1-yl)amino...)
Show SMILES COc1ccc(NC(=O)C2CCC(CNc3c(N4CCCCC4)c(=O)c3=O)CC2)cc1OC
Show InChI InChI=1S/C25H33N3O5/c1-32-19-11-10-18(14-20(19)33-2)27-25(31)17-8-6-16(7-9-17)15-26-21-22(24(30)23(21)29)28-12-4-3-5-13-28/h10-11,14,16-17,26H,3-9,12-13,15H2,1-2H3,(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 placental-like


(Homo sapiens)
BDBM39705
PNG
(4-ethoxy-N-(2-phenylsulfanylethyl)benzenesulfonami...)
Show SMILES CCOc1ccc(cc1)S(=O)(=O)NCCSc1ccccc1
Show InChI InChI=1S/C16H19NO3S2/c1-2-20-14-8-10-16(11-9-14)22(18,19)17-12-13-21-15-6-4-3-5-7-15/h3-11,17H,2,12-13H2,1H3
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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 placental-like


(Homo sapiens)
BDBM39729
PNG
((5E)-5-(2-hydroxy-5-nitro-benzylidene)-2-thioxo-4-...)
Show SMILES Oc1ccc(cc1\C=C1\NC(=S)NC1=O)[N+]([O-])=O
Show InChI InChI=1S/C10H7N3O4S/c14-8-2-1-6(13(16)17)3-5(8)4-7-9(15)12-10(18)11-7/h1-4,14H,(H2,11,12,15,18)/b7-4+
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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 placental-like


(Homo sapiens)
BDBM39735
PNG
(MLS000566764 | N-(diphenylmethyl)-2-[methyl-[(4-ox...)
Show SMILES CN(CC(=O)NC(c1ccccc1)c1ccccc1)Cc1nc2ccccc2c(=O)[nH]1
Show InChI InChI=1S/C25H24N4O2/c1-29(16-22-26-21-15-9-8-14-20(21)25(31)27-22)17-23(30)28-24(18-10-4-2-5-11-18)19-12-6-3-7-13-19/h2-15,24H,16-17H2,1H3,(H,28,30)(H,26,27,31)
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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 placental-like


(Homo sapiens)
BDBM39752
PNG
(1-benzyl-N'-[(1,3-dimethyl-1H-pyrazol-4-yl)met...)
Show SMILES Cc1nn(C)cc1C=NNC(=O)c1ccc2n(Cc3ccccc3)c(C)c(C)c2c1
Show InChI InChI=1S/C24H25N5O/c1-16-18(3)29(14-19-8-6-5-7-9-19)23-11-10-20(12-22(16)23)24(30)26-25-13-21-15-28(4)27-17(21)2/h5-13,15H,14H2,1-4H3,(H,26,30)
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n/an/an/an/a 7.21E+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 placental-like


(Homo sapiens)
BDBM39761
PNG
((5Z)-1-methyl-5-[(5-piperidin-1-ylfuran-2-yl)methy...)
Show SMILES CN1C(=S)NC(=O)\C(=C\c2ccc(o2)N2CCCCC2)C1=O
Show InChI InChI=1S/C15H17N3O3S/c1-17-14(20)11(13(19)16-15(17)22)9-10-5-6-12(21-10)18-7-3-2-4-8-18/h5-6,9H,2-4,7-8H2,1H3,(H,16,19,22)/b11-9-
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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 placental-like


(Homo sapiens)
BDBM39770
PNG
(4-Methyl-2-(3-phenyl-acryloylamino)-thiazole-5-car...)
Show SMILES Cc1nc(NC(=O)\C=C\c2ccccc2)sc1C(=O)Nc1ccccc1Cl
Show InChI InChI=1S/C20H16ClN3O2S/c1-13-18(19(26)23-16-10-6-5-9-15(16)21)27-20(22-13)24-17(25)12-11-14-7-3-2-4-8-14/h2-12H,1H3,(H,23,26)(H,22,24,25)/b12-11+
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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 placental-like


(Homo sapiens)
BDBM39772
PNG
(1-(3,4-Dichloro-benzyl)-azocane | 1-(3,4-dichlorob...)
Show SMILES Clc1ccc(CN2CCCCCCC2)cc1Cl
Show InChI InChI=1S/C14H19Cl2N/c15-13-7-6-12(10-14(13)16)11-17-8-4-2-1-3-5-9-17/h6-7,10H,1-5,8-9,11H2
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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 placental-like


(Homo sapiens)
BDBM39777
PNG
(1-(2-Ethyl-phenyl)-3-(9-thiophen-2-ylmethyl-9-aza-...)
Show SMILES CCc1ccccc1NC(=S)NC1CC2CCCC(C1)N2Cc1cccs1
Show InChI InChI=1S/C22H29N3S2/c1-2-16-7-3-4-11-21(16)24-22(26)23-17-13-18-8-5-9-19(14-17)25(18)15-20-10-6-12-27-20/h3-4,6-7,10-12,17-19H,2,5,8-9,13-15H2,1H3,(H2,23,24,26)
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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 placental-like


(Homo sapiens)
BDBM39788
PNG
(2-bromanyl-N-[1-[(4-nitrophenyl)amino]propan-2-yl]...)
Show SMILES CC(CNc1ccc(cc1)[N+]([O-])=O)NC(=O)c1ccccc1Br
Show InChI InChI=1S/C16H16BrN3O3/c1-11(19-16(21)14-4-2-3-5-15(14)17)10-18-12-6-8-13(9-7-12)20(22)23/h2-9,11,18H,10H2,1H3,(H,19,21)
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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 placental-like


(Homo sapiens)
BDBM39799
PNG
((2E,6Z)-2-[(3-chloranyl-4-methoxy-5-oxidanyl-pheny...)
Show SMILES COc1cc(\C=C2\CCC\C(=C/c3cc(O)c(OC)c(Cl)c3)C2=O)cc(Cl)c1O
Show InChI InChI=1S/C22H20Cl2O5/c1-28-19-11-13(8-16(23)21(19)27)7-15-5-3-4-14(20(15)26)6-12-9-17(24)22(29-2)18(25)10-12/h6-11,25,27H,3-5H2,1-2H3/b14-6+,15-7-
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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 placental-like


(Homo sapiens)
BDBM39802
PNG
(MLS000577776 | N'-[(3,5-dimethyl-1-phenyl-1H-p...)
Show SMILES Cc1nn(c(C)c1C=NNC(=O)c1cc(n[nH]1)-c1ccccc1)-c1ccccc1
Show InChI InChI=1S/C22H20N6O/c1-15-19(16(2)28(27-15)18-11-7-4-8-12-18)14-23-26-22(29)21-13-20(24-25-21)17-9-5-3-6-10-17/h3-14H,1-2H3,(H,24,25)(H,26,29)
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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 placental-like


(Homo sapiens)
BDBM39574
PNG
(2-(4-Furan-2-ylmethyl-5-phenoxymethyl-4H-[1,2,4]tr...)
Show SMILES Cc1cc(NC(=O)CSc2nnc(COc3ccccc3)n2Cc2ccco2)no1
Show InChI InChI=1S/C20H19N5O4S/c1-14-10-17(24-29-14)21-19(26)13-30-20-23-22-18(12-28-15-6-3-2-4-7-15)25(20)11-16-8-5-9-27-16/h2-10H,11-13H2,1H3,(H,21,24,26)
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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 placental-like


(Homo sapiens)
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 placental-like


(Homo sapiens)
BDBM39593
PNG
(6-(3-bromophenyl)-3-(3-methoxyphenyl)-7H-[1,2,4]tr...)
Show SMILES COc1cccc(c1)-c1nnc2SCC(=Nn12)c1cccc(Br)c1
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 placental-like


(Homo sapiens)
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 placental-like


(Homo sapiens)
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 placental-like


(Homo sapiens)
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
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 placental-like


(Homo sapiens)
BDBM39617
PNG
(3-[5-(methylamino)-1,3,4-thiadiazol-2-yl]-1-benzop...)
Show SMILES CNc1nnc(s1)-c1cc2ccccc2oc1=O
Show InChI InChI=1S/C12H9N3O2S/c1-13-12-15-14-10(18-12)8-6-7-4-2-3-5-9(7)17-11(8)16/h2-6H,1H3,(H,13,15)
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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 placental-like


(Homo sapiens)
BDBM39624
PNG
(1-(4-methoxyphenyl)-4-[(2-phenylvinyl)sulfonyl]pip...)
Show SMILES COc1ccc(cc1)N1CCN(CC1)S(=O)(=O)\C=C\c1ccccc1
Show InChI InChI=1S/C19H22N2O3S/c1-24-19-9-7-18(8-10-19)20-12-14-21(15-13-20)25(22,23)16-11-17-5-3-2-4-6-17/h2-11,16H,12-15H2,1H3/b16-11+
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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 placental-like


(Homo sapiens)
BDBM39627
PNG
(1-(3-chloranyl-2-methyl-phenyl)-3-cyclohexyl-urea ...)
Show SMILES Cc1c(Cl)cccc1NC(=O)NC1CCCCC1
Show InChI InChI=1S/C14H19ClN2O/c1-10-12(15)8-5-9-13(10)17-14(18)16-11-6-3-2-4-7-11/h5,8-9,11H,2-4,6-7H2,1H3,(H2,16,17,18)
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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 placental-like


(Homo sapiens)
BDBM39635
PNG
(MLS000112788 | N-[4-(2-methylpiperidin-1-yl)sulfon...)
Show SMILES CC1CCCCN1S(=O)(=O)c1ccc(NC(=O)c2cccs2)cc1
Show InChI InChI=1S/C17H20N2O3S2/c1-13-5-2-3-11-19(13)24(21,22)15-9-7-14(8-10-15)18-17(20)16-6-4-12-23-16/h4,6-10,12-13H,2-3,5,11H2,1H3,(H,18,20)
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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 placental-like


(Homo sapiens)
BDBM39640
PNG
(2-Hydroxy-7,8,9-trimethyl-1H-thieno[2,3-b;4,5-b...)
Show SMILES Cc1nc2sc3c([nH]c(O)cc3=O)c2c(C)c1C
Show InChI InChI=1S/C13H12N2O2S/c1-5-6(2)10-11-12(8(16)4-9(17)15-11)18-13(10)14-7(5)3/h4H,1-3H3,(H2,15,16,17)
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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 placental-like


(Homo sapiens)
BDBM39645
PNG
(2-(5-Phenyl-2H-[1,2,4]triazol-3-yl)-3a,4,7,7a-tetr...)
Show SMILES Oc1c2CC=CCc2c(O)n1-c1nnc([nH]1)-c1ccccc1
Show InChI InChI=1S/C16H14N4O2/c21-14-11-8-4-5-9-12(11)15(22)20(14)16-17-13(18-19-16)10-6-2-1-3-7-10/h1-7,21-22H,8-9H2,(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 placental-like


(Homo sapiens)
BDBM39649
PNG
(3-(1,3-benzothiazol-2-ylsulfanylmethyl)-6-chlorany...)
Show SMILES Clc1ccc2n(CSc3nc4ccccc4s3)c(=O)oc2c1
Show InChI InChI=1S/C15H9ClN2O2S2/c16-9-5-6-11-12(7-9)20-15(19)18(11)8-21-14-17-10-3-1-2-4-13(10)22-14/h1-7H,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 placental-like


(Homo sapiens)
BDBM39653
PNG
(2-(4-fluorophenyl)-2-[4-(4-fluorophenyl)carbonylph...)
Show SMILES Fc1ccc(cc1)C(C#N)c1ccc(cc1)C(=O)c1ccc(F)cc1
Show InChI InChI=1S/C21H13F2NO/c22-18-9-5-15(6-10-18)20(13-24)14-1-3-16(4-2-14)21(25)17-7-11-19(23)12-8-17/h1-12,20H
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n/an/an/an/a 2.31E+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 placental-like


(Homo sapiens)
BDBM39655
PNG
((4-butoxy-3-nitro-phenyl)methyl carbamimidothioate...)
Show SMILES CCCCOc1ccc(CSC(N)=N)cc1[N+]([O-])=O
Show InChI InChI=1S/C12H17N3O3S/c1-2-3-6-18-11-5-4-9(8-19-12(13)14)7-10(11)15(16)17/h4-5,7H,2-3,6,8H2,1H3,(H3,13,14)
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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 placental-like


(Homo sapiens)
BDBM39657
PNG
(MLS000523074 | N-(4-fluorobenzyl)-2-(2-keto-6-pyrr...)
Show SMILES Fc1ccc(CNC(=O)Cn2c3ccc(cc3oc2=O)S(=O)(=O)N2CCCC2)cc1
Show InChI InChI=1S/C20H20FN3O5S/c21-15-5-3-14(4-6-15)12-22-19(25)13-24-17-8-7-16(11-18(17)29-20(24)26)30(27,28)23-9-1-2-10-23/h3-8,11H,1-2,9-10,12-13H2,(H,22,25)
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n/an/an/an/a 457n/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 placental-like


(Homo sapiens)
BDBM39658
PNG
(MLS000518935 | N-ethyl-3-nitro-N-(3-nitrophenyl)az...)
Show SMILES CCN(\N=N\c1cccc(c1)[N+]([O-])=O)c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C14H13N5O4/c1-2-17(12-6-4-8-14(10-12)19(22)23)16-15-11-5-3-7-13(9-11)18(20)21/h3-10H,2H2,1H3/b16-15+
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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 placental-like


(Homo sapiens)
BDBM39676
PNG
(1-N,3-N-dibenzyl-4-chlorobenzene-1,3-disulfonamide...)
Show SMILES Clc1ccc(cc1S(=O)(=O)NCc1ccccc1)S(=O)(=O)NCc1ccccc1
Show InChI InChI=1S/C20H19ClN2O4S2/c21-19-12-11-18(28(24,25)22-14-16-7-3-1-4-8-16)13-20(19)29(26,27)23-15-17-9-5-2-6-10-17/h1-13,22-23H,14-15H2
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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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* indicates data uncertainty>20%