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PubChem AID 779

Compile data set for download or QSAR
Found 134 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
Eph receptor A4


(Mus musculus)
BDBM38280
PNG
(1-(3-Diethylamino-propyl)-1-(7-oxo-2,3,6,7-tetrahy...)
Show SMILES CCN(CC)CCCN(Cc1cc2cc3OCCOc3cc2[nH]c1=O)C(=O)Nc1ccccc1
Show InChI InChI=1S/C26H32N4O4/c1-3-29(4-2)11-8-12-30(26(32)27-21-9-6-5-7-10-21)18-20-15-19-16-23-24(34-14-13-33-23)17-22(19)28-25(20)31/h5-7,9-10,15-17H,3-4,8,11-14,18H2,1-2H3,(H,27,32)(H,28,31)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44428
PNG
(2-(4-Ethyl-5-o-tolyloxymethyl-4H-[1,2,4]triazol-3-...)
Show SMILES CCn1c(COc2ccccc2C)nnc1SCC(=O)Nc1cc(C)on1
Show InChI InChI=1S/C18H21N5O3S/c1-4-23-16(10-25-14-8-6-5-7-12(14)2)20-21-18(23)27-11-17(24)19-15-9-13(3)26-22-15/h5-9H,4,10-11H2,1-3H3,(H,19,22,24)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM38802
PNG
(MLS000038842 | SMR000040243 | cid_659226)
Show SMILES CCOC(=O)C(C(=O)OCC)c1cc(Br)c2noc3-c4ccccc4C(=O)c1c23
Show InChI InChI=1S/C21H16BrNO6/c1-3-27-20(25)15(21(26)28-4-2)12-9-13(22)17-16-14(12)18(24)10-7-5-6-8-11(10)19(16)29-23-17/h5-9,15H,3-4H2,1-2H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44435
PNG
(2-cyano-2-[3-(3-methyl-1-piperidinyl)-2-quinoxalin...)
Show SMILES CC1CCCN(C1)c1nc2ccccc2nc1C(C#N)C(=O)OC1CCCCC1
Show InChI InChI=1S/C23H28N4O2/c1-16-8-7-13-27(15-16)22-21(25-19-11-5-6-12-20(19)26-22)18(14-24)23(28)29-17-9-3-2-4-10-17/h5-6,11-12,16-18H,2-4,7-10,13,15H2,1H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44448
PNG
(MLS000091077 | N-[2-(2-methyl-1-indolyl)ethyl]benz...)
Show SMILES Cc1cc2ccccc2n1CCNC(=O)c1ccccc1
Show InChI InChI=1S/C18H18N2O/c1-14-13-16-9-5-6-10-17(16)20(14)12-11-19-18(21)15-7-3-2-4-8-15/h2-10,13H,11-12H2,1H3,(H,19,21)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44451
PNG
(MLS000043622 | N-(2-oxidanylidene-1,3-benzoxathiol...)
Show SMILES CC(=O)N(c1ccc2oc(=O)sc2c1)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C15H11NO5S2/c1-10(17)16(23(19,20)12-5-3-2-4-6-12)11-7-8-13-14(9-11)22-15(18)21-13/h2-9H,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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44461
PNG
(5-[(2-methoxyphenyl)-oxomethoxy]-1-phenyl-3-pyrazo...)
Show SMILES CCOC(=O)c1cc(OC(=O)c2ccccc2OC)n(n1)-c1ccccc1
Show InChI InChI=1S/C20H18N2O5/c1-3-26-20(24)16-13-18(22(21-16)14-9-5-4-6-10-14)27-19(23)15-11-7-8-12-17(15)25-2/h4-13H,3H2,1-2H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44463
PNG
(2-acetamido-6-formyl-7-(phenylthio)-4,5-dihydro-1-...)
Show SMILES CCOC(=O)c1c(NC(C)=O)sc2c1CCC(C=O)=C2Sc1ccccc1
Show InChI InChI=1S/C20H19NO4S2/c1-3-25-20(24)16-15-10-9-13(11-22)17(26-14-7-5-4-6-8-14)18(15)27-19(16)21-12(2)23/h4-8,11H,3,9-10H2,1-2H3,(H,21,23)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44467
PNG
(MLS000531830 | N-(4-methoxyphenyl)-N-(2,4,5-trichl...)
Show SMILES COc1ccc(cc1)N(C(=O)c1ccco1)S(=O)(=O)c1cc(Cl)c(Cl)cc1Cl
Show InChI InChI=1S/C18H12Cl3NO5S/c1-26-12-6-4-11(5-7-12)22(18(23)16-3-2-8-27-16)28(24,25)17-10-14(20)13(19)9-15(17)21/h2-10H,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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44468
PNG
(2-[3-[(4-chlorophenyl)methyl]-6,7-dimethoxy-4-oxid...)
Show SMILES CCN(CC)C(=O)CSc1nc2cc(OC)c(OC)cc2c(=O)n1Cc1ccc(Cl)cc1
Show InChI InChI=1S/C23H26ClN3O4S/c1-5-26(6-2)21(28)14-32-23-25-18-12-20(31-4)19(30-3)11-17(18)22(29)27(23)13-15-7-9-16(24)10-8-15/h7-12H,5-6,13-14H2,1-4H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44477
PNG
(2-(5-Furan-2-yl-2,2-dimethyl-10-methylsulfanyl-1,4...)
Show SMILES CSc1nc(SCCO)c2sc3nc(-c4ccco4)c4COC(C)(C)Cc4c3c2n1
Show InChI InChI=1S/C21H21N3O3S3/c1-21(2)9-11-12(10-27-21)15(13-5-4-7-26-13)22-18-14(11)16-17(30-18)19(29-8-6-25)24-20(23-16)28-3/h4-5,7,25H,6,8-10H2,1-3H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44486
PNG
(1-(7-ethyl-1H-indol-3-yl)-2-[[4-methyl-5-(2-methyl...)
Show SMILES CCc1cccc2c(c[nH]c12)C(=O)CSc1nnc(-c2ccoc2C)n1C
Show InChI InChI=1S/C20H20N4O2S/c1-4-13-6-5-7-15-16(10-21-18(13)15)17(25)11-27-20-23-22-19(24(20)3)14-8-9-26-12(14)2/h5-10,21H,4,11H2,1-3H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44493
PNG
(5-bromanyl-2-oxidanyl-3-[(E)-3-phenylprop-2-enoyl]...)
Show SMILES Oc1c(cc(Br)ccc1=O)C(=O)\C=C\c1ccccc1
Show InChI InChI=1S/C16H11BrO3/c17-12-7-9-15(19)16(20)13(10-12)14(18)8-6-11-4-2-1-3-5-11/h1-10H,(H,19,20)/b8-6+
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44501
PNG
(5-Bromo-furan-2-carboxylic acid [3-cyano-1-(4-meth...)
Show SMILES COc1ccc(cc1)-n1c(NC(=O)c2ccc(Br)o2)c(C#N)c2nc3ccccc3nc12
Show InChI InChI=1S/C23H14BrN5O3/c1-31-14-8-6-13(7-9-14)29-21(28-23(30)18-10-11-19(24)32-18)15(12-25)20-22(29)27-17-5-3-2-4-16(17)26-20/h2-11H,1H3,(H,28,30)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44508
PNG
(2-[({2-[3-(methyloxy)phenyl]-1,3-dioxolan-2-yl}met...)
Show SMILES COc1cccc(c1)C1(CSc2nnc(o2)-c2cc(OC)c(OC)c(OC)c2)OCCO1
Show InChI InChI=1S/C22H24N2O7S/c1-25-16-7-5-6-15(12-16)22(29-8-9-30-22)13-32-21-24-23-20(31-21)14-10-17(26-2)19(28-4)18(11-14)27-3/h5-7,10-12H,8-9,13H2,1-4H3
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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 (2008)


BindingDB Entry DOI: 10.7270/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM39775
PNG
((5E)-5-[(E)-3-[4-(dimethylamino)phenyl]prop-2-enyl...)
Show SMILES CN(C)c1ccc(\C=C\C=C2\SC(=S)N(C2=O)c2ccccc2)cc1
Show InChI InChI=1S/C20H18N2OS2/c1-21(2)16-13-11-15(12-14-16)7-6-10-18-19(23)22(20(24)25-18)17-8-4-3-5-9-17/h3-14H,1-2H3/b7-6+,18-10+
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44512
PNG
(2-(7-Methyl-2-piperidin-1-yl-quinolin-3-ylmethylen...)
Show SMILES Cc1ccc2cc(C=C(C#N)C#N)c(nc2c1)N1CCCCC1
Show InChI InChI=1S/C19H18N4/c1-14-5-6-16-11-17(10-15(12-20)13-21)19(22-18(16)9-14)23-7-3-2-4-8-23/h5-6,9-11H,2-4,7-8H2,1H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44527
PNG
((4-chlorophenyl)-[2-[(E)-2-(dimethylamino)ethenyl]...)
Show SMILES COc1ccc2oc(\C=C\N(C)C)c(C(=O)c3ccc(Cl)cc3)c2c1
Show InChI InChI=1S/C20H18ClNO3/c1-22(2)11-10-18-19(20(23)13-4-6-14(21)7-5-13)16-12-15(24-3)8-9-17(16)25-18/h4-12H,1-3H3/b11-10+
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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 (2008)


BindingDB Entry DOI: 10.7270/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44533
PNG
(2-[[anilino(sulfanylidene)methyl]amino]-6-(2-pheny...)
Show SMILES CCOC(=O)c1c(NC(=S)Nc2ccccc2)sc2CN(CCc3ccccc3)CCc12
Show InChI InChI=1S/C25H27N3O2S2/c1-2-30-24(29)22-20-14-16-28(15-13-18-9-5-3-6-10-18)17-21(20)32-23(22)27-25(31)26-19-11-7-4-8-12-19/h3-12H,2,13-17H2,1H3,(H2,26,27,31)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44429
PNG
(1-(3-fluoranyl-4-methoxy-phenyl)-2-morpholin-4-yl-...)
Show SMILES COc1ccc(cc1F)C(=O)CN1CCOCC1
Show InChI InChI=1S/C13H16FNO3/c1-17-13-3-2-10(8-11(13)14)12(16)9-15-4-6-18-7-5-15/h2-3,8H,4-7,9H2,1H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44437
PNG
(1-ethyl-3-phenyl-pyrazolo[4,3-b]quinoxaline | 1-et...)
Show SMILES CCn1nc(-c2ccccc2)c2nc3ccccc3nc12
Show InChI InChI=1S/C17H14N4/c1-2-21-17-16(15(20-21)12-8-4-3-5-9-12)18-13-10-6-7-11-14(13)19-17/h3-11H,2H2,1H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM38409
PNG
(MLS000084961 | SMR000019307 | Thiocarbonic acid S-...)
Show SMILES COC(=O)Sc1nnc(o1)-c1ccc(Br)cc1
Show InChI InChI=1S/C10H7BrN2O3S/c1-15-10(14)17-9-13-12-8(16-9)6-2-4-7(11)5-3-6/h2-5H,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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM34399
PNG
(2,4-dimethyl-N-(4-methyl-1,3-benzothiazol-2-yl)-1,...)
Show SMILES Cc1nc(C)c(o1)C(=O)Nc1nc2c(C)cccc2s1
Show InChI InChI=1S/C14H13N3O2S/c1-7-5-4-6-10-11(7)16-14(20-10)17-13(18)12-8(2)15-9(3)19-12/h4-6H,1-3H3,(H,16,17,18)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44452
PNG
(1-esyl-N-[2-(N-ethylanilino)ethyl]nipecotamide | M...)
Show SMILES CCN(CCNC(=O)C1CCCN(C1)S(=O)(=O)CC)c1ccccc1
Show InChI InChI=1S/C18H29N3O3S/c1-3-20(17-10-6-5-7-11-17)14-12-19-18(22)16-9-8-13-21(15-16)25(23,24)4-2/h5-7,10-11,16H,3-4,8-9,12-15H2,1-2H3,(H,19,22)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44465
PNG
((Z)-2-dibutoxyphosphoryl-3-hydroxy-2-butenenitrile...)
Show SMILES CCCCOP(=O)(OCCCC)C(C#N)C(C)=O
Show InChI InChI=1S/C12H22NO4P/c1-4-6-8-16-18(15,17-9-7-5-2)12(10-13)11(3)14/h12H,4-9H2,1-3H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM33087
PNG
(2,3-bis(2-furanyl)-N-(phenylmethyl)-6-quinoxalinec...)
Show SMILES O=C(NCc1ccccc1)c1ccc2nc(-c3ccco3)c(nc2c1)-c1ccco1
Show InChI InChI=1S/C24H17N3O3/c28-24(25-15-16-6-2-1-3-7-16)17-10-11-18-19(14-17)27-23(21-9-5-13-30-21)22(26-18)20-8-4-12-29-20/h1-14H,15H2,(H,25,28)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44472
PNG
(1-Butyl-3-phenyl-1H-pyrazolo[3,4-b]quinoxaline | 1...)
Show SMILES CCCCn1nc(-c2ccccc2)c2nc3ccccc3nc12
Show InChI InChI=1S/C19H18N4/c1-2-3-13-23-19-18(17(22-23)14-9-5-4-6-10-14)20-15-11-7-8-12-16(15)21-19/h4-12H,2-3,13H2,1H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44476
PNG
(2-[Ethyl-(4-furan-2-yl-9-methylsulfanyl-2,3-dihydr...)
Show SMILES CCN(CCO)c1nc(SC)nc2c1sc1nc(-c3ccco3)c3CCCc3c21
Show InChI InChI=1S/C21H22N4O2S2/c1-3-25(9-10-26)19-18-17(23-21(24-19)28-2)15-12-6-4-7-13(12)16(22-20(15)29-18)14-8-5-11-27-14/h5,8,11,26H,3-4,6-7,9-10H2,1-2H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM40226
PNG
((1-Benzenesulfonylamino-3-bromo-4-oxo-1,4-dihydro-...)
Show SMILES CCOP(=O)(OCC)C1(NS(=O)(=O)c2ccccc2)C=C(Br)C(=O)c2ccccc12
Show InChI InChI=1S/C20H21BrNO6PS/c1-3-27-29(24,28-4-2)20(22-30(25,26)15-10-6-5-7-11-15)14-18(21)19(23)16-12-8-9-13-17(16)20/h5-14,22H,3-4H2,1-2H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44479
PNG
(9-Chloro-6-ethyl-6H-indolo[2,3-b]quinoxaline | 9-c...)
Show SMILES CCn1c2ccc(Cl)cc2c2nc3ccccc3nc12
Show InChI InChI=1S/C16H12ClN3/c1-2-20-14-8-7-10(17)9-11(14)15-16(20)19-13-6-4-3-5-12(13)18-15/h3-9H,2H2,1H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM41028
PNG
(2-[(5Z)-5-[(E)-3-(2-furanyl)prop-2-enylidene]-4-ox...)
Show SMILES CC(N1C(=S)S\C(=C/C=C/c2ccco2)C1=O)C(O)=O
Show InChI InChI=1S/C13H11NO4S2/c1-8(12(16)17)14-11(15)10(20-13(14)19)6-2-4-9-5-3-7-18-9/h2-8H,1H3,(H,16,17)/b4-2+,10-6-
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44491
PNG
(2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[3-c...)
Show SMILES Cc1ccsc1\C=C\C1=Cc2c(C#N)c(NC(=O)CSc3nnc(N)[nH]3)sc2C(C)(C)C1
Show InChI InChI=1S/C22H22N6OS3/c1-12-6-7-30-16(12)5-4-13-8-14-15(10-23)19(32-18(14)22(2,3)9-13)25-17(29)11-31-21-26-20(24)27-28-21/h4-8H,9,11H2,1-3H3,(H,25,29)(H3,24,26,27,28)/b5-4+
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44494
PNG
(2-[(E)-3-(1,3-benzodioxol-5-yl)-1-oxoprop-2-enyl]-...)
Show SMILES CCNc1ccc(Br)cc(C(=O)\C=C\c2ccc3OCOc3c2)c1=O
Show InChI InChI=1S/C19H16BrNO4/c1-2-21-15-6-5-13(20)10-14(19(15)23)16(22)7-3-12-4-8-17-18(9-12)25-11-24-17/h3-10H,2,11H2,1H3,(H,21,23)/b7-3+
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM43212
PNG
((5Z)-5-[(2Z)-2-(1-ethyl-3,3-dimethyl-2-indolyliden...)
Show SMILES CCCN1C(=S)S\C(=C/C=C2\N(CC)c3ccccc3C2(C)C)C1=O
Show InChI InChI=1S/C20H24N2OS2/c1-5-13-22-18(23)16(25-19(22)24)11-12-17-20(3,4)14-9-7-8-10-15(14)21(17)6-2/h7-12H,5-6,13H2,1-4H3/b16-11-,17-12-
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44515
PNG
(2-[(4-fluoroanilino)carbamoyl]benzoic acid | 2-[[(...)
Show SMILES OC(=O)c1ccccc1C(=O)NNc1ccc(F)cc1
Show InChI InChI=1S/C14H11FN2O3/c15-9-5-7-10(8-6-9)16-17-13(18)11-3-1-2-4-12(11)14(19)20/h1-8,16H,(H,17,18)(H,19,20)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44521
PNG
(2,3,6-triphenylimidazo[1,2-b][1,2,4]triazine | MLS...)
Show SMILES c1c(nc2nc(-c3ccccc3)c(nn12)-c1ccccc1)-c1ccccc1
Show InChI InChI=1S/C23H16N4/c1-4-10-17(11-5-1)20-16-27-23(24-20)25-21(18-12-6-2-7-13-18)22(26-27)19-14-8-3-9-15-19/h1-16H
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44525
PNG
((2E)-2-(2-pyridinylhydrazinylidene)-1-naphthalenon...)
Show SMILES Oc1c(ccc2ccccc12)N=Nc1ccccn1
Show InChI InChI=1S/C15H11N3O/c19-15-12-6-2-1-5-11(12)8-9-13(15)17-18-14-7-3-4-10-16-14/h1-10,19H
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44530
PNG
(3-keto-7-phenyl-5-(2-thienyl)-2-(3,4,5-trimethoxyb...)
Show SMILES CCOC(=O)C1=C(N=c2sc(=Cc3cc(OC)c(OC)c(OC)c3)c(=O)n2C1c1cccs1)c1ccccc1
Show InChI InChI=1S/C29H26N2O6S2/c1-5-37-28(33)23-24(18-10-7-6-8-11-18)30-29-31(25(23)21-12-9-13-38-21)27(32)22(39-29)16-17-14-19(34-2)26(36-4)20(15-17)35-3/h6-16,25H,5H2,1-4H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44531
PNG
(5-[(1-cyclohexyl-2,5-dimethyl-1H-pyrrol-3-yl)methy...)
Show SMILES CN1C(=S)N(C)C(=O)C(=Cc2cc(C)n(C3CCCCC3)c2C)C1=O
Show InChI InChI=1S/C19H25N3O2S/c1-12-10-14(13(2)22(12)15-8-6-5-7-9-15)11-16-17(23)20(3)19(25)21(4)18(16)24/h10-11,15H,5-9H2,1-4H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44425
PNG
(2-[4-(2-furoyl)-1,4-diazepan-1-yl]-6,8-dimethyl-qu...)
Show SMILES Cc1cc(C)c2nc(N3CCCN(CC3)C(=O)c3ccco3)c(cc2c1)C#N
Show InChI InChI=1S/C22H22N4O2/c1-15-11-16(2)20-17(12-15)13-18(14-23)21(24-20)25-6-4-7-26(9-8-25)22(27)19-5-3-10-28-19/h3,5,10-13H,4,6-9H2,1-2H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44427
PNG
(2-(4-Fluoro-phenyl)-9-morpholin-4-yl-5,6,7,8-tetra...)
Show SMILES Fc1ccc(cc1)-c1cc2nc3CCCCc3c(N3CCOCC3)n2n1
Show InChI InChI=1S/C20H21FN4O/c21-15-7-5-14(6-8-15)18-13-19-22-17-4-2-1-3-16(17)20(25(19)23-18)24-9-11-26-12-10-24/h5-8,13H,1-4,9-12H2
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM31751
PNG
(3-[(2-chlorobenzyl)thio]-5,6-bis(2-furyl)-1,2,4-tr...)
Show SMILES Clc1ccccc1CSc1nnc(-c2ccco2)c(n1)-c1ccco1
Show InChI InChI=1S/C18H12ClN3O2S/c19-13-6-2-1-5-12(13)11-25-18-20-16(14-7-3-9-23-14)17(21-22-18)15-8-4-10-24-15/h1-10H,11H2
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM40838
PNG
(7-[(3,5-dimethoxy-4-oxidanyl-phenyl)-(pyridin-2-yl...)
Show SMILES COc1cc(cc(OC)c1O)C(Nc1ccccn1)c1ccc2ccc(C)nc2c1O
Show InChI InChI=1S/C24H23N3O4/c1-14-7-8-15-9-10-17(23(28)22(15)26-14)21(27-20-6-4-5-11-25-20)16-12-18(30-2)24(29)19(13-16)31-3/h4-13,21,28-29H,1-3H3,(H,25,27)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44449
PNG
(2-[2,1,3-benzothiadiazol-4-ylsulfonyl(methyl)amino...)
Show SMILES CCN(CCCNC(=O)CN(C)S(=O)(=O)c1cccc2nsnc12)c1cccc(C)c1
Show InChI InChI=1S/C21H27N5O3S2/c1-4-26(17-9-5-8-16(2)14-17)13-7-12-22-20(27)15-25(3)31(28,29)19-11-6-10-18-21(19)24-30-23-18/h5-6,8-11,14H,4,7,12-13,15H2,1-3H3,(H,22,27)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44464
PNG
(2-(2-chloro-N-mesyl-anilino)-N-(3-chlorophenyl)ace...)
Show SMILES CS(=O)(=O)N(CC(=O)Nc1cccc(Cl)c1)c1ccccc1Cl
Show InChI InChI=1S/C15H14Cl2N2O3S/c1-23(21,22)19(14-8-3-2-7-13(14)17)10-15(20)18-12-6-4-5-11(16)9-12/h2-9H,10H2,1H3,(H,18,20)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44469
PNG
(2,3-bis(2-furanyl)-N-(2-phenylethyl)-6-quinoxaline...)
Show SMILES O=C(NCCc1ccccc1)c1ccc2nc(-c3ccco3)c(nc2c1)-c1ccco1
Show InChI InChI=1S/C25H19N3O3/c29-25(26-13-12-17-6-2-1-3-7-17)18-10-11-19-20(16-18)28-24(22-9-5-15-31-22)23(27-19)21-8-4-14-30-21/h1-11,14-16H,12-13H2,(H,26,29)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44481
PNG
((2Z)-2-cyano-2-[3-(dibutylamino)-1H-quinoxalin-2-y...)
Show SMILES CCCCN(CCCC)c1nc2ccccc2nc1C(C#N)C(=O)OCC
Show InChI InChI=1S/C21H28N4O2/c1-4-7-13-25(14-8-5-2)20-19(16(15-22)21(26)27-6-3)23-17-11-9-10-12-18(17)24-20/h9-12,16H,4-8,13-14H2,1-3H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44495
PNG
(3-(2-furyl)-1-(4-nitrophenyl)-5-phenyl-2-pyrazolin...)
Show SMILES [O-][N+](=O)c1ccc(cc1)N1N=C(CC1c1ccccc1)c1ccco1
Show InChI InChI=1S/C19H15N3O3/c23-22(24)16-10-8-15(9-11-16)21-18(14-5-2-1-3-6-14)13-17(20-21)19-7-4-12-25-19/h1-12,18H,13H2
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44498
PNG
(2-Chloro-5-{5-[5-cyano-2-hydroxy-4-methyl-6-oxo-6H...)
Show SMILES CC1=C(C#N)C(=O)NC(=O)\C1=C/c1ccc(o1)-c1ccc(Cl)c(c1)C(=O)OCC=C
Show InChI InChI=1S/C22H15ClN2O5/c1-3-8-29-22(28)16-9-13(4-6-18(16)23)19-7-5-14(30-19)10-15-12(2)17(11-24)21(27)25-20(15)26/h3-7,9-10H,1,8H2,2H3,(H,25,26,27)/b15-10-
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44500
PNG
(MLS000544060 | N-[(Z)-1-(1-naphthylcarbamoyl)-2-(4...)
Show SMILES [O-][N+](=O)c1ccc(\C=C(/NC(=O)c2ccccc2)C(=O)Nc2cccc3ccccc23)cc1
Show InChI InChI=1S/C26H19N3O4/c30-25(20-8-2-1-3-9-20)28-24(17-18-13-15-21(16-14-18)29(32)33)26(31)27-23-12-6-10-19-7-4-5-11-22(19)23/h1-17H,(H,27,31)(H,28,30)/b24-17-
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44516
PNG
(1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4...)
Show SMILES Cc1c(NC(=S)NN=Cc2cccc(O)c2)c(=O)n(-c2ccccc2)n1C
Show InChI InChI=1S/C19H19N5O2S/c1-13-17(18(26)24(23(13)2)15-8-4-3-5-9-15)21-19(27)22-20-12-14-7-6-10-16(25)11-14/h3-12,25H,1-2H3,(H2,21,22,27)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44517
PNG
((5Z)-3-anilino-2-sulfanylidene-5-[(3,4,5-trimethox...)
Show SMILES COc1cc(\C=C2/SC(=S)N(Nc3ccccc3)C2=O)cc(OC)c1OC
Show InChI InChI=1S/C19H18N2O4S2/c1-23-14-9-12(10-15(24-2)17(14)25-3)11-16-18(22)21(19(26)27-16)20-13-7-5-4-6-8-13/h4-11,20H,1-3H3/b16-11-
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44518
PNG
(4-(2-pyridinylsulfanyl)-1-(trifluoromethyl)[1,2,4]...)
Show SMILES FC(F)(F)c1nnc2c(Sc3ccccn3)nc3ccccc3n12
Show InChI InChI=1S/C15H8F3N5S/c16-15(17,18)14-22-21-12-13(24-11-7-3-4-8-19-11)20-9-5-1-2-6-10(9)23(12)14/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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44522
PNG
(2-[[4-allyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]...)
Show SMILES FC(F)(F)c1ccc(Cl)c(Cc2cnc(NC(=O)CSc3nnc(-c4ccncc4)n3CC=C)s2)c1
Show InChI InChI=1S/C23H18ClF3N6OS2/c1-2-9-33-20(14-5-7-28-8-6-14)31-32-22(33)35-13-19(34)30-21-29-12-17(36-21)11-15-10-16(23(25,26)27)3-4-18(15)24/h2-8,10,12H,1,9,11,13H2,(H,29,30,34)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44524
PNG
(2-(3,4-dimethoxybenzylidene)-5,6-diphenylimidazo[2...)
Show SMILES COc1ccc(C=c2sc3nc(c(-c4ccccc4)n3c2=O)-c2ccccc2)cc1OC
Show InChI InChI=1S/C26H20N2O3S/c1-30-20-14-13-17(15-21(20)31-2)16-22-25(29)28-24(19-11-7-4-8-12-19)23(27-26(28)32-22)18-9-5-3-6-10-18/h3-16H,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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44433
PNG
(2-cyano-2-[3-(4-ethyl-1-piperazinyl)-2-quinoxaliny...)
Show SMILES CCCCCCOC(=O)C(C#N)c1nc2ccccc2nc1N1CCN(CC)CC1
Show InChI InChI=1S/C23H31N5O2/c1-3-5-6-9-16-30-23(29)18(17-24)21-22(28-14-12-27(4-2)13-15-28)26-20-11-8-7-10-19(20)25-21/h7-8,10-11,18H,3-6,9,12-16H2,1-2H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44436
PNG
(3-phenyl-1-propyl-pyrazolo[4,3-b]quinoxaline | 3-p...)
Show SMILES CCCn1nc(-c2ccccc2)c2nc3ccccc3nc12
Show InChI InChI=1S/C18H16N4/c1-2-12-22-18-17(16(21-22)13-8-4-3-5-9-13)19-14-10-6-7-11-15(14)20-18/h3-11H,2,12H2,1H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44438
PNG
(2-methyl-3-(4-methylphenyl)[1]benzopyrano[2,3-d]py...)
Show SMILES Cc1ccc(cc1)-n1c(C)nc2oc3ccccc3c(=O)c2c1=O
Show InChI InChI=1S/C19H14N2O3/c1-11-7-9-13(10-8-11)21-12(2)20-18-16(19(21)23)17(22)14-5-3-4-6-15(14)24-18/h3-10H,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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM40101
PNG
(2-(4-methoxyphenyl)-3-oxidanylidene-1H-isoindole-4...)
Show SMILES COc1ccc(cc1)N1Cc2cccc(C(O)=O)c2C1=O
Show InChI InChI=1S/C16H13NO4/c1-21-12-7-5-11(6-8-12)17-9-10-3-2-4-13(16(19)20)14(10)15(17)18/h2-8H,9H2,1H3,(H,19,20)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44454
PNG
(2-(2-furanylmethylidene)-5-(3-methoxyphenyl)-7-met...)
Show SMILES CCOC(=O)C1=C(C)N=c2sc(=Cc3ccco3)c(=O)n2C1c1cccc(OC)c1
Show InChI InChI=1S/C22H20N2O5S/c1-4-28-21(26)18-13(2)23-22-24(19(18)14-7-5-8-15(11-14)27-3)20(25)17(30-22)12-16-9-6-10-29-16/h5-12,19H,4H2,1-3H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44457
PNG
((4Z)-4-[(2-methylsulfanylanilino)methylidene]-2-ph...)
Show SMILES CSc1ccccc1N=Cc1nc(oc1O)-c1ccccc1
Show InChI InChI=1S/C17H14N2O2S/c1-22-15-10-6-5-9-13(15)18-11-14-17(20)21-16(19-14)12-7-3-2-4-8-12/h2-11,20H,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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44466
PNG
((5Z)-3-(5-chloranyl-2-methyl-phenyl)-2-methyl-5-[(...)
Show SMILES Cc1ccc(Cl)cc1-n1c([CH2-])nc([CH+]c2ccc(cc2)[N+]([O-])=O)c1O
Show InChI InChI=1S/C18H14ClN3O3/c1-11-3-6-14(19)10-17(11)21-12(2)20-16(18(21)23)9-13-4-7-15(8-5-13)22(24)25/h3-10,23H,2H2,1H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44480
PNG
(1-(3-Amino-6-thiophen-2-yl-4-trifluoromethyl-thien...)
Show SMILES CC(C)(C)C(=O)c1sc2nc(cc(c2c1N)C(F)(F)F)-c1cccs1
Show InChI InChI=1S/C17H15F3N2OS2/c1-16(2,3)14(23)13-12(21)11-8(17(18,19)20)7-9(22-15(11)25-13)10-5-4-6-24-10/h4-7H,21H2,1-3H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44482
PNG
(2-[(5Z)-5-[(E)-3-(2-furanyl)prop-2-enylidene]-4-ox...)
Show SMILES CC(C)C(N1C(=S)S\C(=C/C=C/c2ccco2)C1=O)C(O)=O
Show InChI InChI=1S/C15H15NO4S2/c1-9(2)12(14(18)19)16-13(17)11(22-15(16)21)7-3-5-10-6-4-8-20-10/h3-9,12H,1-2H3,(H,18,19)/b5-3+,11-7-
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44490
PNG
((3Z)-1-ethyl-6-(6-oxidanylidene-4,5-dihydro-1H-pyr...)
Show SMILES CCN1C(=O)C(C=NN=Cc2ccccc2)c2ccc(cc12)C1=NNC(=O)CC1
Show InChI InChI=1S/C22H21N5O2/c1-2-27-20-12-16(19-10-11-21(28)26-25-19)8-9-17(20)18(22(27)29)14-24-23-13-15-6-4-3-5-7-15/h3-9,12-14,18H,2,10-11H2,1H3,(H,26,28)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44505
PNG
((5Z)-3-butyl-2-sulfanylidene-5-[(2Z)-2-(1,3,3-trim...)
Show SMILES CCCCN1C(=S)S\C(=C/C=C2\N(C)c3ccccc3C2(C)C)C1=O
Show InChI InChI=1S/C20H24N2OS2/c1-5-6-13-22-18(23)16(25-19(22)24)11-12-17-20(2,3)14-9-7-8-10-15(14)21(17)4/h7-12H,5-6,13H2,1-4H3/b16-11-,17-12-
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44532
PNG
(3-[(5Z)-4-keto-5-[(E)-3-phenylprop-2-enylidene]-2-...)
Show SMILES O=C(CCN1C(=S)S\C(=C/C=C/c2ccccc2)C1=O)Nc1nccs1
Show InChI InChI=1S/C18H15N3O2S3/c22-15(20-17-19-10-12-25-17)9-11-21-16(23)14(26-18(21)24)8-4-7-13-5-2-1-3-6-13/h1-8,10,12H,9,11H2,(H,19,20,22)/b7-4+,14-8-
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44426
PNG
(MLS000027789 | N-(5-p-anisyl-1,3,4-thiadiazol-2-yl...)
Show SMILES COc1ccc(Cc2nnc(NC(=O)Cc3cccs3)s2)cc1
Show InChI InChI=1S/C16H15N3O2S2/c1-21-12-6-4-11(5-7-12)9-15-18-19-16(23-15)17-14(20)10-13-3-2-8-22-13/h2-8H,9-10H2,1H3,(H,17,19,20)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44430
PNG
(2-[[3-cyano-4-(2-furanyl)-6-phenyl-2-pyridinyl]thi...)
Show SMILES COC(=O)CSc1nc(cc(-c2ccco2)c1C#N)-c1ccccc1
Show InChI InChI=1S/C19H14N2O3S/c1-23-18(22)12-25-19-15(11-20)14(17-8-5-9-24-17)10-16(21-19)13-6-3-2-4-7-13/h2-10H,12H2,1H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM34172
PNG
(MLS000038673 | N-(5-ethylsulfanyl-1,3,4-thiadiazol...)
Show SMILES CCSc1nnc(NC(=O)C(C(F)(F)F)C(F)(F)F)s1
Show InChI InChI=1S/C8H7F6N3OS2/c1-2-19-6-17-16-5(20-6)15-4(18)3(7(9,10)11)8(12,13)14/h3H,2H2,1H3,(H,15,16,18)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44434
PNG
(2-cyano-2-(3-piperidinoquinoxalin-2-yl)acetic acid...)
Show SMILES CCC(C)COC(=O)C(C#N)c1nc2ccccc2nc1N1CCCCC1
Show InChI InChI=1S/C21H26N4O2/c1-3-15(2)14-27-21(26)16(13-22)19-20(25-11-7-4-8-12-25)24-18-10-6-5-9-17(18)23-19/h5-6,9-10,15-16H,3-4,7-8,11-12,14H2,1-2H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM31698
PNG
(3-bromanyl-5-(3,3-dimethylpiperidin-1-yl)carbonyl-...)
Show SMILES CC1(C)CCCN(C1)C(=O)c1coc(=O)c(Br)c1
Show InChI InChI=1S/C13H16BrNO3/c1-13(2)4-3-5-15(8-13)11(16)9-6-10(14)12(17)18-7-9/h6-7H,3-5,8H2,1-2H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44439
PNG
(2-(3-pyrrolidin-1-ylquinoxalin-2-yl)-2-thiophen-2-...)
Show SMILES O=S(=O)(C(C#N)c1nc2ccccc2nc1N1CCCC1)c1cccs1
Show InChI InChI=1S/C18H16N4O2S2/c19-12-15(26(23,24)16-8-5-11-25-16)17-18(22-9-3-4-10-22)21-14-7-2-1-6-13(14)20-17/h1-2,5-8,11,15H,3-4,9-10H2
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44446
PNG
(4-[2-[[(5Z)-5-(3-indolylidene)-4-(2-methoxyethyl)-...)
Show SMILES CCOC(=O)N1CCN(CC1)C(=O)CSc1nnc(-c2c[nH]c3ccccc23)n1CCOC
Show InChI InChI=1S/C22H28N6O4S/c1-3-32-22(30)27-10-8-26(9-11-27)19(29)15-33-21-25-24-20(28(21)12-13-31-2)17-14-23-18-7-5-4-6-16(17)18/h4-7,14,23H,3,8-13,15H2,1-2H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44447
PNG
(2-(2-o-toluoylpyrrol-1-yl)-N-(tetrahydrofurfuryl)a...)
Show SMILES Cc1ccccc1C(=O)c1cccn1CC(=O)NCC1CCCO1
Show InChI InChI=1S/C19H22N2O3/c1-14-6-2-3-8-16(14)19(23)17-9-4-10-21(17)13-18(22)20-12-15-7-5-11-24-15/h2-4,6,8-10,15H,5,7,11-13H2,1H3,(H,20,22)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44450
PNG
((3,5-dimethylpyrazol-1-yl)methyl-[4-(trifluorometh...)
Show SMILES Cc1cc(C)n(CNc2nc(cs2)C(F)(F)F)n1
Show InChI InChI=1S/C10H11F3N4S/c1-6-3-7(2)17(16-6)5-14-9-15-8(4-18-9)10(11,12)13/h3-4H,5H2,1-2H3,(H,14,15)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM40660
PNG
(5-(2-furanyl)-2,3,5,6-tetrahydro-1H-benzo[a]phenan...)
Show SMILES O=C1CCCC2=C1C(Nc1ccc3ccccc3c21)c1ccco1
Show InChI InChI=1S/C21H17NO2/c23-17-8-3-7-15-19-14-6-2-1-5-13(14)10-11-16(19)22-21(20(15)17)18-9-4-12-24-18/h1-2,4-6,9-12,21-22H,3,7-8H2
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44458
PNG
(4-[[benzenesulfonyl(2-pyridinyl)amino]methyl]benzo...)
Show SMILES OC(=O)c1ccc(CN(c2ccccn2)S(=O)(=O)c2ccccc2)cc1
Show InChI InChI=1S/C19H16N2O4S/c22-19(23)16-11-9-15(10-12-16)14-21(18-8-4-5-13-20-18)26(24,25)17-6-2-1-3-7-17/h1-13H,14H2,(H,22,23)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44460
PNG
(1-Amino-4-bromo-anthraquinone | 1-amino-4-bromo-9,...)
Show SMILES Nc1ccc(Br)c2C(=O)c3ccccc3C(=O)c12
Show InChI InChI=1S/C14H8BrNO2/c15-9-5-6-10(16)12-11(9)13(17)7-3-1-2-4-8(7)14(12)18/h1-6H,16H2
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM41590
PNG
(6-methoxy-2-(4-methoxyphenyl)-3-[3-(trifluoromethy...)
Show SMILES COc1ccc(cc1)-c1c(Sc2cccc(c2)C(F)(F)F)c2ccc(OC)cc2s1=O
Show InChI InChI=1S/C23H17F3O3S2/c1-28-16-8-6-14(7-9-16)22-21(19-11-10-17(29-2)13-20(19)31(22)27)30-18-5-3-4-15(12-18)23(24,25)26/h3-13H,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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44473
PNG
((4-Methoxy-phenyl)-(10-methyl-11-pyridin-3-yl-8-p-...)
Show SMILES COc1ccc(NC2=Nc3ccccc3N3C(c4c(C)nn(c4N=C23)-c2ccc(C)cc2)c2cccnc2)cc1
Show InChI InChI=1S/C32H27N7O/c1-20-10-14-24(15-11-20)39-31-28(21(2)37-39)29(22-7-6-18-33-19-22)38-27-9-5-4-8-26(27)35-30(32(38)36-31)34-23-12-16-25(40-3)17-13-23/h4-19,29H,1-3H3,(H,34,35)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44488
PNG
((5Z)-3-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-...)
Show SMILES COc1cc(C=C2SC(=S)N(Nc3ncc(cc3Cl)C(F)(F)F)C2=O)cc(OC)c1OC
Show InChI InChI=1S/C19H15ClF3N3O4S2/c1-28-12-4-9(5-13(29-2)15(12)30-3)6-14-17(27)26(18(31)32-14)25-16-11(20)7-10(8-24-16)19(21,22)23/h4-8H,1-3H3,(H,24,25)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44489
PNG
(5-hydroxy-2-methyl-4-[4-morpholinyl(3-pyridinyl)me...)
Show SMILES CCOC(=O)c1c(C)oc2c1c(C(N1CCOCC1)c1cccnc1)c(O)c1ccccc21
Show InChI InChI=1S/C26H26N2O5/c1-3-32-26(30)20-16(2)33-25-19-9-5-4-8-18(19)24(29)22(21(20)25)23(17-7-6-10-27-15-17)28-11-13-31-14-12-28/h4-10,15,23,29H,3,11-14H2,1-2H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44497
PNG
(6-(5-ethylsulfanyl-1,3,4-oxadiazol-2-yl)-3,4-diphe...)
Show SMILES CCSc1nnc(o1)-c1sc2nnc(-c3ccccc3)c(-c3ccccc3)c2c1N
Show InChI InChI=1S/C22H17N5OS2/c1-2-29-22-27-25-20(28-22)19-17(23)16-15(13-9-5-3-6-10-13)18(24-26-21(16)30-19)14-11-7-4-8-12-14/h3-12H,2,23H2,1H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44499
PNG
((5E)-5-(1H-benzimidazol-2-ylmethylene)-3-(4-fluoro...)
Show SMILES Fc1ccc(cc1)N1C(=S)S\C(=C\c2nc3ccccc3[nH]2)C1=O
Show InChI InChI=1S/C17H10FN3OS2/c18-10-5-7-11(8-6-10)21-16(22)14(24-17(21)23)9-15-19-12-3-1-2-4-13(12)20-15/h1-9H,(H,19,20)/b14-9+
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44507
PNG
(1-Methyl-4-nitro-1H-pyrazole-3-carboxylic acid (2,...)
Show SMILES Cn1cc(c(n1)C(=O)Nc1ccc2OCCOc2c1)[N+]([O-])=O
Show InChI InChI=1S/C13H12N4O5/c1-16-7-9(17(19)20)12(15-16)13(18)14-8-2-3-10-11(6-8)22-5-4-21-10/h2-3,6-7H,4-5H2,1H3,(H,14,18)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM32287
PNG
((5E)-5-[[5-(2-chlorophenyl)-2-furanyl]methylidene]...)
Show SMILES Clc1ccccc1-c1ccc(\C=C2\SC(=S)N(CC3CCCO3)C2=O)o1
Show InChI InChI=1S/C19H16ClNO3S2/c20-15-6-2-1-5-14(15)16-8-7-12(24-16)10-17-18(22)21(19(25)26-17)11-13-4-3-9-23-13/h1-2,5-8,10,13H,3-4,9,11H2/b17-10+
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44510
PNG
((E)-3-(1,3-benzothiazol-2-ylhydrazo)-1-phenyl-2-bu...)
Show SMILES CC(CC(=O)c1ccccc1)N=Nc1nc2ccccc2s1
Show InChI InChI=1S/C17H15N3OS/c1-12(11-15(21)13-7-3-2-4-8-13)19-20-17-18-14-9-5-6-10-16(14)22-17/h2-10,12H,11H2,1H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44511
PNG
((5E)-3-benzyl-5-(2-furfurylidene)-2-thioxo-thiazol...)
Show SMILES O=C1N(Cc2ccccc2)C(=S)S\C1=C\c1ccco1
Show InChI InChI=1S/C15H11NO2S2/c17-14-13(9-12-7-4-8-18-12)20-15(19)16(14)10-11-5-2-1-3-6-11/h1-9H,10H2/b13-9+
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44513
PNG
(2-(3-Benzyl-quinolin-2-ylsulfanyl)-N-(2,5-dimethox...)
Show SMILES COc1ccc(OC)c(NC(=O)CSc2nc3ccccc3cc2Cc2ccccc2)c1
Show InChI InChI=1S/C26H24N2O3S/c1-30-21-12-13-24(31-2)23(16-21)27-25(29)17-32-26-20(14-18-8-4-3-5-9-18)15-19-10-6-7-11-22(19)28-26/h3-13,15-16H,14,17H2,1-2H3,(H,27,29)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44519
PNG
(2-(N-besyl-2,5-dimethyl-anilino)-N-[[5-(4-nitrophe...)
Show SMILES Cc1ccc(C)c(c1)N(CC(=O)N\N=C\c1ccc(o1)-c1ccc(cc1)[N+]([O-])=O)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C27H24N4O6S/c1-19-8-9-20(2)25(16-19)30(38(35,36)24-6-4-3-5-7-24)18-27(32)29-28-17-23-14-15-26(37-23)21-10-12-22(13-11-21)31(33)34/h3-17H,18H2,1-2H3,(H,29,32)/b28-17+
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM39932
PNG
(MLS000082573 | SMR000046177 | cid_665043)
Show SMILES CSc1nc(NCCOCCO)c2sc3nc(c4CCCc4c3c2n1)-c1ccco1
Show InChI InChI=1S/C21H22N4O3S2/c1-29-21-24-17-15-12-4-2-5-13(12)16(14-6-3-9-28-14)23-20(15)30-18(17)19(25-21)22-7-10-27-11-8-26/h3,6,9,26H,2,4-5,7-8,10-11H2,1H3,(H,22,24,25)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44440
PNG
(2-[[4-methyl-5-(2-methyl-3-furanyl)-1,2,4-triazol-...)
Show SMILES Cc1occc1-c1nnc(SCC(=O)Nc2ccccc2-c2ccccc2)n1C
Show InChI InChI=1S/C22H20N4O2S/c1-15-17(12-13-28-15)21-24-25-22(26(21)2)29-14-20(27)23-19-11-7-6-10-18(19)16-8-4-3-5-9-16/h3-13H,14H2,1-2H3,(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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44444
PNG
(1-[2-[(4-methylphenyl)methylamino]-2-oxidanylidene...)
Show SMILES Cc1ccc(CNC(=O)CN2CCC(CC2)C(N)=O)cc1
Show InChI InChI=1S/C16H23N3O2/c1-12-2-4-13(5-3-12)10-18-15(20)11-19-8-6-14(7-9-19)16(17)21/h2-5,14H,6-11H2,1H3,(H2,17,21)(H,18,20)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM35501
PNG
(4-[2,3-bis(2-furyl)quinoxalin-6-yl]sulfonylmorphol...)
Show SMILES O=S(=O)(N1CCOCC1)c1ccc2nc(-c3ccco3)c(nc2c1)-c1ccco1
Show InChI InChI=1S/C20H17N3O5S/c24-29(25,23-7-11-26-12-8-23)14-5-6-15-16(13-14)22-20(18-4-2-10-28-18)19(21-15)17-3-1-9-27-17/h1-6,9-10,13H,7-8,11-12H2
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44455
PNG
((4Z)-4-[(E)-3-(2-furanyl)prop-2-enylidene]-2-(prop...)
Show SMILES CCCSC1=N\C(=C/C=C/c2ccco2)C(=O)S1
Show InChI InChI=1S/C13H13NO2S2/c1-2-9-17-13-14-11(12(15)18-13)7-3-5-10-6-4-8-16-10/h3-8H,2,9H2,1H3/b5-3+,11-7-
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44459
PNG
(1,1,3-Trimethyl-2-[3-(1,3,3-trimethyl-1,3-dihydro-...)
Show SMILES CN1\C(=C/C=C/C2=[N+](C)c3ccc4ccccc4c3C2(C)C)C(C)(C)c2ccccc12
Show InChI InChI=1S/C29H31N2/c1-28(2)22-14-9-10-15-23(22)30(5)25(28)16-11-17-26-29(3,4)27-21-13-8-7-12-20(21)18-19-24(27)31(26)6/h7-19H,1-6H3/q+1
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44462
PNG
(5-({[4-ethyl-5-(2-thienyl)-4H-1,2,4-triazol-3-yl]t...)
Show SMILES CCn1c(SCc2nc(no2)-c2ccccc2)nnc1-c1cccs1
Show InChI InChI=1S/C17H15N5OS2/c1-2-22-16(13-9-6-10-24-13)19-20-17(22)25-11-14-18-15(21-23-14)12-7-4-3-5-8-12/h3-10H,2,11H2,1H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44474
PNG
(MLS000555438 | N-[4-(10-Methyl-8,11-diphenyl-8,11-...)
Show SMILES CC(=O)Nc1ccc(NC2=Nc3ccccc3N3C(c4c(C)nn(c4N=C23)-c2ccccc2)c2ccccc2)cc1
Show InChI InChI=1S/C33H27N7O/c1-21-29-30(23-11-5-3-6-12-23)39-28-16-10-9-15-27(28)36-31(35-25-19-17-24(18-20-25)34-22(2)41)33(39)37-32(29)40(38-21)26-13-7-4-8-14-26/h3-20,30H,1-2H3,(H,34,41)(H,35,36)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44475
PNG
(1-Pentyl-3-phenyl-1H-pyrazolo[3,4-b]quinoxaline | ...)
Show SMILES CCCCCn1nc(-c2ccccc2)c2nc3ccccc3nc12
Show InChI InChI=1S/C20H20N4/c1-2-3-9-14-24-20-19(18(23-24)15-10-5-4-6-11-15)21-16-12-7-8-13-17(16)22-20/h4-8,10-13H,2-3,9,14H2,1H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44484
PNG
((5Z)-3-(1,1-diketothiolan-3-yl)-5-[[1-phenyl-3-(4-...)
Show SMILES CCCOc1ccc(cc1)-c1nn(cc1\C=C1/SC(=S)N(C2CCS(=O)(=O)C2)C1=O)-c1ccccc1
Show InChI InChI=1S/C26H25N3O4S3/c1-2-13-33-22-10-8-18(9-11-22)24-19(16-28(27-24)20-6-4-3-5-7-20)15-23-25(30)29(26(34)35-23)21-12-14-36(31,32)17-21/h3-11,15-16,21H,2,12-14,17H2,1H3/b23-15-
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44485
PNG
(2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-7-(trif...)
Show SMILES CC1Cc2ccccc2N1Cc1nc2cc(ccc2c(=O)[nH]1)C(F)(F)F
Show InChI InChI=1S/C19H16F3N3O/c1-11-8-12-4-2-3-5-16(12)25(11)10-17-23-15-9-13(19(20,21)22)6-7-14(15)18(26)24-17/h2-7,9,11H,8,10H2,1H3,(H,23,24,26)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM40697
PNG
(4-(2,3-dihydroimidazo[2,1-b][1,3]thiazol-6-yl)-1,2...)
Show SMILES Oc1ccc(cc1O)-c1cn2CCSc2n1
Show InChI InChI=1S/C11H10N2O2S/c14-9-2-1-7(5-10(9)15)8-6-13-3-4-16-11(13)12-8/h1-2,5-6,14-15H,3-4H2
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44492
PNG
(4-methoxy-N-[4-oxidanyl-3-(1H-1,2,4-triazol-5-ylsu...)
Show SMILES COc1ccc(cc1)S(=O)(=O)Nc1cc(Sc2nnc[nH]2)c(O)c2ccccc12
Show InChI InChI=1S/C19H16N4O4S2/c1-27-12-6-8-13(9-7-12)29(25,26)23-16-10-17(28-19-20-11-21-22-19)18(24)15-5-3-2-4-14(15)16/h2-11,23-24H,1H3,(H,20,21,22)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44503
PNG
(4-methyl-6-(phenylmethyl)-7,8-dihydropurino[7,8-a]...)
Show SMILES Cn1c2nc3N(Cc4ccccc4)CCn3c2c(=O)[nH]c1=O
Show InChI InChI=1S/C15H15N5O2/c1-18-12-11(13(21)17-15(18)22)20-8-7-19(14(20)16-12)9-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H,17,21,22)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44506
PNG
(1-Benzyl-3-(2-nitro-vinyl)-1H-indole | 1-benzyl-3-...)
Show SMILES [O-][N+](=O)\C=C\c1cn(Cc2ccccc2)c2ccccc12
Show InChI InChI=1S/C17H14N2O2/c20-19(21)11-10-15-13-18(12-14-6-2-1-3-7-14)17-9-5-4-8-16(15)17/h1-11,13H,12H2/b11-10+
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM39773
PNG
((2Z)-3-ethyl-2-[(1-ethyl-8-methyl-2-quinolin-1-ium...)
Show SMILES CCN1\C(Sc2ccccc12)=C\c1ccc2cccc(C)c2[n+]1CC
Show InChI InChI=1S/C22H23N2S/c1-4-23-18(14-13-17-10-8-9-16(3)22(17)23)15-21-24(5-2)19-11-6-7-12-20(19)25-21/h6-15H,4-5H2,1-3H3/q+1
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44528
PNG
((4Z)-4-[(8-methyl-2-morpholin-4-yl-quinolin-3-yl)m...)
Show SMILES Cc1cccc2cc(\C=C3/N=C(OC3=O)c3ccccc3)c(nc12)N1CCOCC1
Show InChI InChI=1S/C24H21N3O3/c1-16-6-5-9-18-14-19(22(26-21(16)18)27-10-12-29-13-11-27)15-20-24(28)30-23(25-20)17-7-3-2-4-8-17/h2-9,14-15H,10-13H2,1H3/b20-15-
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44175
PNG
(1-(2-Fluoro-phenyl)-4-[(4-methoxy-phenyl)-(1-thiop...)
Show SMILES COc1ccc(cc1)C(N1CCN(CC1)c1ccccc1F)c1nnnn1Cc1cccs1
Show InChI InChI=1S/C24H25FN6OS/c1-32-19-10-8-18(9-11-19)23(24-26-27-28-31(24)17-20-5-4-16-33-20)30-14-12-29(13-15-30)22-7-3-2-6-21(22)25/h2-11,16,23H,12-15,17H2,1H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44441
PNG
(MLS000098295 | SMR000066971 | cid_2998095)
Show SMILES Cc1nn(c2N=C3C=CC(=CN3C(c12)c1cccnc1)S(=O)(=O)N1CCCCC1)-c1ccccc1
Show InChI InChI=1S/C26H26N6O2S/c1-19-24-25(20-9-8-14-27-17-20)31-18-22(35(33,34)30-15-6-3-7-16-30)12-13-23(31)28-26(24)32(29-19)21-10-4-2-5-11-21/h2,4-5,8-14,17-18,25H,3,6-7,15-16H2,1H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44443
PNG
(2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[3-cyano...)
Show SMILES CC(C)CC(N1C(=O)c2ccccc2C1=O)C(=O)Nc1oc(-c2ccco2)c(-c2ccco2)c1C#N
Show InChI InChI=1S/C27H21N3O6/c1-15(2)13-19(30-26(32)16-7-3-4-8-17(16)27(30)33)24(31)29-25-18(14-28)22(20-9-5-11-34-20)23(36-25)21-10-6-12-35-21/h3-12,15,19H,13H2,1-2H3,(H,29,31)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44445
PNG
(3-(1,3-benzodioxol-5-ylmethyl)-7-(piperidin-1-ylca...)
Show SMILES O=C(N1CCCCC1)c1ccc2c(c1)[nH]c(=S)n(Cc1ccc3OCOc3c1)c2=O
Show InChI InChI=1S/C22H21N3O4S/c26-20(24-8-2-1-3-9-24)15-5-6-16-17(11-15)23-22(30)25(21(16)27)12-14-4-7-18-19(10-14)29-13-28-18/h4-7,10-11H,1-3,8-9,12-13H2,(H,23,30)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM34502
PNG
(3-(2-methoxyphenyl)-8-(4-methylsulfanylphenyl)-6-o...)
Show SMILES COc1ccccc1N1CSC2=C(C#N)C(CC(=O)N2C1)c1ccc(SC)cc1
Show InChI InChI=1S/C22H21N3O2S2/c1-27-20-6-4-3-5-19(20)24-13-25-21(26)11-17(18(12-23)22(25)29-14-24)15-7-9-16(28-2)10-8-15/h3-10,17H,11,13-14H2,1-2H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44470
PNG
((5Z)-2-(4-methylphenyl)-3-phenylazanyl-5-(thiophen...)
Show SMILES Cc1ccc(cc1)C1=N\C(=C/c2cccs2)C(=O)N1Nc1ccccc1
Show InChI InChI=1S/C21H17N3OS/c1-15-9-11-16(12-10-15)20-22-19(14-18-8-5-13-26-18)21(25)24(20)23-17-6-3-2-4-7-17/h2-14,23H,1H3/b19-14-
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44471
PNG
((E)-2-(4-methylphenyl)sulfonyl-3-(2-morpholin-4-yl...)
Show SMILES Cc1ccc(cc1)S(=O)(=O)C(=C\c1c(nc2ccccn2c1=O)N1CCOCC1)\C#N
Show InChI InChI=1S/C22H20N4O4S/c1-16-5-7-17(8-6-16)31(28,29)18(15-23)14-19-21(25-10-12-30-13-11-25)24-20-4-2-3-9-26(20)22(19)27/h2-9,14H,10-13H2,1H3/b18-14+
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44478
PNG
(2-(3-bromophenyl)-5-(4-bromophenyl)-1,3,4-oxadiazo...)
Show SMILES Brc1ccc(cc1)-c1nnc(o1)-c1cccc(Br)c1
Show InChI InChI=1S/C14H8Br2N2O/c15-11-6-4-9(5-7-11)13-17-18-14(19-13)10-2-1-3-12(16)8-10/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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44483
PNG
((5Z)-3-butan-2-yl-5-[[9-methyl-4-oxidanylidene-2-(...)
Show SMILES CCC(C)N1C(=S)S\C(=C/c2c(NCCCOC(C)C)nc3c(C)cccn3c2=O)C1=O
Show InChI InChI=1S/C23H30N4O3S2/c1-6-16(5)27-22(29)18(32-23(27)31)13-17-19(24-10-8-12-30-14(2)3)25-20-15(4)9-7-11-26(20)21(17)28/h7,9,11,13-14,16,24H,6,8,10,12H2,1-5H3/b18-13-
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44487
PNG
(2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[3-c...)
Show SMILES CCOc1ccc(\C=C\C2=Cc3c(C#N)c(NC(=O)CSc4nnc(N)[nH]4)sc3C(C)(C)C2)cc1
Show InChI InChI=1S/C25H26N6O2S2/c1-4-33-17-9-7-15(8-10-17)5-6-16-11-18-19(13-26)22(35-21(18)25(2,3)12-16)28-20(32)14-34-24-29-23(27)30-31-24/h5-11H,4,12,14H2,1-3H3,(H,28,32)(H3,27,29,30,31)/b6-5+
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44496
PNG
(4-(2,2,2-trifluoroethoxymethyl)-N-(3,4,5-trimethox...)
Show SMILES COc1cc(NC(=O)c2ccc(COCC(F)(F)F)cc2)cc(OC)c1OC
Show InChI InChI=1S/C19H20F3NO5/c1-25-15-8-14(9-16(26-2)17(15)27-3)23-18(24)13-6-4-12(5-7-13)10-28-11-19(20,21)22/h4-9H,10-11H2,1-3H3,(H,23,24)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44514
PNG
(3-Amino-4-phenyl-6-thiophen-2-yl-thieno[2,3-b]pyri...)
Show SMILES Nc1c(sc2nc(cc(-c3ccccc3)c12)-c1cccs1)C#N
Show InChI InChI=1S/C18H11N3S2/c19-10-15-17(20)16-12(11-5-2-1-3-6-11)9-13(21-18(16)23-15)14-7-4-8-22-14/h1-9H,20H2
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM39794
PNG
((E)-1-(3-bromophenyl)-3-[4-(dimethylamino)phenyl]-...)
Show SMILES CN(C)c1ccc(\C=C\C(=O)c2cccc(Br)c2)cc1
Show InChI InChI=1S/C17H16BrNO/c1-19(2)16-9-6-13(7-10-16)8-11-17(20)14-4-3-5-15(18)12-14/h3-12H,1-2H3/b11-8+
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44526
PNG
((4-nitrophenyl)-diphenyl-amine | (4-nitrophenyl)di...)
Show SMILES [O-][N+](=O)c1ccc(cc1)N(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C18H14N2O2/c21-20(22)18-13-11-17(12-14-18)19(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-14H
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44431
PNG
(MLS000038382 | SMR000040281 | cid_6463323)
Show SMILES Cl.CC(=O)OC1(CN2CCC1c1ccccc21)c1ccc(C)cc1
Show InChI InChI=1S/C20H21NO2.ClH/c1-14-7-9-16(10-8-14)20(23-15(2)22)13-21-12-11-18(20)17-5-3-4-6-19(17)21;/h3-10,18H,11-13H2,1-2H3;1H
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44432
PNG
(6-amino-3-isopropyl-8-thioxo-3,4-dihydro-1H-thiopy...)
Show SMILES CC(C)C1Cc2c(CO1)c(=S)sc(N)c2C#N
Show InChI InChI=1S/C12H14N2OS2/c1-6(2)10-3-7-8(4-13)11(14)17-12(16)9(7)5-15-10/h6,10H,3,5,14H2,1-2H3
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44442
PNG
(2-(1-methyl-2-benzimidazolyl)-2-[4-oxo-3-prop-2-en...)
Show SMILES COc1cc(C=c2s\c(=C(\C#N)c3nc4ccccc4n3C)n(CC=C)c2=O)cc(OC)c1OC
Show InChI InChI=1S/C26H24N4O4S/c1-6-11-30-25(31)22(14-16-12-20(32-3)23(34-5)21(13-16)33-4)35-26(30)17(15-27)24-28-18-9-7-8-10-19(18)29(24)2/h6-10,12-14H,1,11H2,2-5H3/b22-14?,26-17-
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44453
PNG
(MLS000102133 | N-[(1,2-dimethyl-5-indolyl)methyl]-...)
Show SMILES Cc1cc2cc(CNC(=O)c3ccc(cc3)S(=O)(=O)N3CCCCC3)ccc2n1C
Show InChI InChI=1S/C23H27N3O3S/c1-17-14-20-15-18(6-11-22(20)25(17)2)16-24-23(27)19-7-9-21(10-8-19)30(28,29)26-12-4-3-5-13-26/h6-11,14-15H,3-5,12-13,16H2,1-2H3,(H,24,27)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44456
PNG
(3-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(1,5-dim...)
Show SMILES Cc1c(NC(=O)CCN2C(=O)c3ccccc3C2=O)c(=O)n(-c2ccccc2)n1C
Show InChI InChI=1S/C22H20N4O4/c1-14-19(22(30)26(24(14)2)15-8-4-3-5-9-15)23-18(27)12-13-25-20(28)16-10-6-7-11-17(16)21(25)29/h3-11H,12-13H2,1-2H3,(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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44502
PNG
(5-(2,5-Dimethyl-phenoxymethyl)-[1,3,4]thiadiazol-2...)
Show SMILES Cc1ccc(C)c(OCc2nnc(N)s2)c1
Show InChI InChI=1S/C11H13N3OS/c1-7-3-4-8(2)9(5-7)15-6-10-13-14-11(12)16-10/h3-5H,6H2,1-2H3,(H2,12,14)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44504
PNG
(2-chloro-5-[5-[(E)-(5-cyano-2,6-diketo-4-methyl-3-...)
Show SMILES CCOC(=O)c1cc(ccc1Cl)-c1ccc(\C=C2\C(=O)NC(=O)C(C#N)=C2C)o1
Show InChI InChI=1S/C21H15ClN2O5/c1-3-28-21(27)15-8-12(4-6-17(15)22)18-7-5-13(29-18)9-14-11(2)16(10-23)20(26)24-19(14)25/h4-9H,3H2,1-2H3,(H,24,25,26)/b14-9+
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44509
PNG
(1,2-dimethoxy-9-thioxanthenone | 1,2-dimethoxy-9H-...)
Show SMILES COc1ccc2sc3ccccc3c(=O)c2c1OC
Show InChI InChI=1S/C15H12O3S/c1-17-10-7-8-12-13(15(10)18-2)14(16)9-5-3-4-6-11(9)19-12/h3-8H,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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM41075
PNG
(2-(N-(4-ethoxyphenyl)sulfonylanilino)-N-[[5-(4-nit...)
Show SMILES CCOc1ccc(cc1)S(=O)(=O)N(CC(=O)N\N=C\c1ccc(o1)-c1ccc(cc1)[N+]([O-])=O)c1ccccc1
Show InChI InChI=1S/C27H24N4O7S/c1-2-37-23-12-15-25(16-13-23)39(35,36)30(21-6-4-3-5-7-21)19-27(32)29-28-18-24-14-17-26(38-24)20-8-10-22(11-9-20)31(33)34/h3-18H,2,19H2,1H3,(H,29,32)/b28-18+
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44520
PNG
((4Z)-4-[(7-methyl-2-morpholin-4-yl-quinolin-3-yl)m...)
Show SMILES Cc1ccc2cc(\C=C3/N=C(OC3=O)c3ccccc3)c(nc2c1)N1CCOCC1
Show InChI InChI=1S/C24H21N3O3/c1-16-7-8-18-14-19(22(25-20(18)13-16)27-9-11-29-12-10-27)15-21-24(28)30-23(26-21)17-5-3-2-4-6-17/h2-8,13-15H,9-12H2,1H3/b21-15-
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44523
PNG
((4Z)-2-(ethylthio)-4-[[5-(2-nitrophenyl)-2-furanyl...)
Show SMILES CCSC1=N\C(=C/c2ccc(o2)-c2ccccc2[N+]([O-])=O)C(=O)S1
Show InChI InChI=1S/C16H12N2O4S2/c1-2-23-16-17-12(15(19)24-16)9-10-7-8-14(22-10)11-5-3-4-6-13(11)18(20)21/h3-9H,2H2,1H3/b12-9-
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
Eph receptor A4


(Mus musculus)
BDBM44529
PNG
(2-chloranyl-5-nitro-N-(5,6,7,8-tetrahydronaphthale...)
Show SMILES [O-][N+](=O)c1ccc(Cl)c(c1)C(=O)Nc1cccc2CCCCc12
Show InChI InChI=1S/C17H15ClN2O3/c18-15-9-8-12(20(22)23)10-14(15)17(21)19-16-7-3-5-11-4-1-2-6-13(11)16/h3,5,7-10H,1-2,4,6H2,(H,19,21)
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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/Q2JD4V5T
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%