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Compile Data Set for Download or QSAR

Found 38 hits Enz. Inhib. hit(s) with Target = 'Baculoviral IAP repeat-containing protein 5' AND taxid = 9606   
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
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50442671
PNG
(CHEMBL2442083)
Show SMILES CCN(CC)CCOc1ccc(CCCCc2ccc(OCCN(CC)CC)c(OCCN(CC)CC)c2)cc1OCCN(CC)CC
Show InChI InChI=1S/C40H70N4O4/c1-9-41(10-2)25-29-45-37-23-21-35(33-39(37)47-31-27-43(13-5)14-6)19-17-18-20-36-22-24-38(46-30-26-42(11-3)12-4)40(34-36)48-32-28-44(15-7)16-8/h21-24,33-34H,9-20,25-32H2,1-8H3
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n/an/a 2.50E+4n/an/an/an/an/an/a



National University of Singapore

Curated by ChEMBL


Assay Description
Inhibition of survivin (unknown origin)


Bioorg Med Chem Lett 23: 6127-33 (2013)


Article DOI: 10.1016/j.bmcl.2013.09.014
BindingDB Entry DOI: 10.7270/Q2W95BNB
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50573761
PNG
(CHEMBL4862376)
Show SMILES Oc1c(CN2CCCCC2)cc(Cn2ncc(n2)-c2ccc(cc2)C(F)(F)F)c2cccnc12
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n/an/an/a 4.27E+3n/an/an/an/an/a


TBA

Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 assessed as dissociation constant measured by Surface plasmon resonance


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113719
BindingDB Entry DOI: 10.7270/Q2VQ36HZ
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209190
PNG
(CHEMBL272921 | N-(5-chloro-3-(4-(2-chloro-5-(trifl...)
Show SMILES CCCC(=O)N1CCC(CC1)C(=O)N(C)Cc1cc(Cl)cc(c1O)-c1cc(-c2cc(ccc2Cl)C(F)(F)F)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C31H29Cl2F3N4O4/c1-3-4-27(41)40-9-7-17(8-10-40)30(44)39(2)16-18-11-20(32)13-23(28(18)42)26-14-21(24(15-37)29(43)38-26)22-12-19(31(34,35)36)5-6-25(22)33/h5-6,11-14,17,42H,3-4,7-10,16H2,1-2H3,(H,38,43)
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n/an/an/a 60n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209202
PNG
(CHEMBL234608 | N-(5-chloro-3-(4-(2-chloro-5-(trifl...)
Show SMILES Oc1c(CNC(=O)C2CCCCC2)cc(Cl)cc1-c1cc(-c2cc(ccc2Cl)C(F)(F)F)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C27H22Cl2F3N3O3/c28-17-8-15(13-34-25(37)14-4-2-1-3-5-14)24(36)20(10-17)23-11-18(21(12-33)26(38)35-23)19-9-16(27(30,31)32)6-7-22(19)29/h6-11,14,36H,1-5,13H2,(H,34,37)(H,35,38)
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n/an/an/a 880n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209193
PNG
(CHEMBL234330 | N-(5-chloro-3-(4-(2-chloro-5-(trifl...)
Show SMILES COCC(=O)N1CCC(CC1)C(=O)N(C)Cc1cc(Cl)cc(c1O)-c1cc(-c2cc(ccc2Cl)C(F)(F)F)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C30H27Cl2F3N4O5/c1-38(29(43)16-5-7-39(8-6-16)26(40)15-44-2)14-17-9-19(31)11-22(27(17)41)25-12-20(23(13-36)28(42)37-25)21-10-18(30(33,34)35)3-4-24(21)32/h3-4,9-12,16,41H,5-8,14-15H2,1-2H3,(H,37,42)
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n/an/an/a 64n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209203
PNG
(CHEMBL392285 | N-(5-chloro-3-(4-(2-chloro-5-(trifl...)
Show SMILES CN(Cc1cc(Cl)cc(c1O)-c1cc(-c2cc(ccc2Cl)C(F)(F)F)c(C#N)c(=O)[nH]1)C(=O)C1CCCCC1
Show InChI InChI=1S/C28H24Cl2F3N3O3/c1-36(27(39)15-5-3-2-4-6-15)14-16-9-18(29)11-21(25(16)37)24-12-19(22(13-34)26(38)35-24)20-10-17(28(31,32)33)7-8-23(20)30/h7-12,15,37H,2-6,14H2,1H3,(H,35,38)
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n/an/an/a 620n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209192
PNG
(6-(5-bromo-2-hydroxyphenyl)-4-(2,5-dimethylphenyl)...)
Show SMILES Cc1ccc(C)c(c1)-c1cc([nH]c(=O)c1C#N)-c1cc(Br)ccc1O
Show InChI InChI=1S/C20H15BrN2O2/c1-11-3-4-12(2)14(7-11)15-9-18(23-20(25)17(15)10-22)16-8-13(21)5-6-19(16)24/h3-9,24H,1-2H3,(H,23,25)
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n/an/an/a 1.17E+3n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209196
PNG
(6-(5-bromo-2-hydroxy-phenyl)-4-(4-chloro-biphenyl-...)
Show SMILES Oc1ccc(Br)cc1-c1cc(-c2cc(ccc2Cl)-c2ccccc2)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C24H14BrClN2O2/c25-16-7-9-23(29)19(11-16)22-12-17(20(13-27)24(30)28-22)18-10-15(6-8-21(18)26)14-4-2-1-3-5-14/h1-12,29H,(H,28,30)
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n/an/an/a>4.30E+3n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209191
PNG
(6-(5-cyclopentyl-2-hydroxyphenyl)-4-(2,5-dichlorop...)
Show SMILES Oc1ccc(cc1-c1cc(-c2cc(Cl)ccc2Cl)c(C#N)c(=O)[nH]1)C1CCCC1
Show InChI InChI=1S/C23H18Cl2N2O2/c24-15-6-7-20(25)17(10-15)16-11-21(27-23(29)19(16)12-26)18-9-14(5-8-22(18)28)13-3-1-2-4-13/h5-11,13,28H,1-4H2,(H,27,29)
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n/an/an/a 510n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209188
PNG
(6-(2-Hydroxy-phenyl)-2-oxo-4-phenyl-1,2-dihydro-py...)
Show SMILES Oc1ccccc1-c1cc(-c2ccccc2)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C18H12N2O2/c19-11-15-14(12-6-2-1-3-7-12)10-16(20-18(15)22)13-8-4-5-9-17(13)21/h1-10,21H,(H,20,22)
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n/an/an/a 7.50E+4n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209210
PNG
(CHEMBL392286 | N-(5-chloro-3-(4-(2-chloro-5-(trifl...)
Show SMILES CN(Cc1cc(Cl)cc(c1O)-c1cc(-c2cc(ccc2Cl)C(F)(F)F)c(C#N)c(=O)[nH]1)C(=O)C1CCNCC1
Show InChI InChI=1S/C27H23Cl2F3N4O3/c1-36(26(39)14-4-6-34-7-5-14)13-15-8-17(28)10-20(24(15)37)23-11-18(21(12-33)25(38)35-23)19-9-16(27(30,31)32)2-3-22(19)29/h2-3,8-11,14,34,37H,4-7,13H2,1H3,(H,35,38)
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n/an/an/a 530n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209195
PNG
(4-(2,5-dichloro-phenyl)-6-(4-hydroxy-biphenyl-3-yl...)
Show SMILES Oc1ccc(cc1-c1cc(-c2cc(Cl)ccc2Cl)c(C#N)c(=O)[nH]1)-c1ccccc1
Show InChI InChI=1S/C24H14Cl2N2O2/c25-16-7-8-21(26)18(11-16)17-12-22(28-24(30)20(17)13-27)19-10-15(6-9-23(19)29)14-4-2-1-3-5-14/h1-12,29H,(H,28,30)
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n/an/an/a 700n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209207
PNG
(CHEMBL394046 | tert-butyl 4-((5-chloro-3-(4-(2-chl...)
Show SMILES CN(Cc1cc(Cl)cc(c1O)-c1cc(-c2cc(ccc2Cl)C(F)(F)F)c(C#N)c(=O)[nH]1)C(=O)C1CCN(CC1)C(=O)OC(C)(C)C
Show InChI InChI=1S/C32H31Cl2F3N4O5/c1-31(2,3)46-30(45)41-9-7-17(8-10-41)29(44)40(4)16-18-11-20(33)13-23(27(18)42)26-14-21(24(15-38)28(43)39-26)22-12-19(32(35,36)37)5-6-25(22)34/h5-6,11-14,17,42H,7-10,16H2,1-4H3,(H,39,43)
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n/an/an/a 260n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209209
PNG
(6-(5-bromo-2-hydroxyphenyl)-4-(2,5-dichlorophenyl)...)
Show SMILES Oc1ccc(Br)cc1-c1cc(-c2cc(Cl)ccc2Cl)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C18H9BrCl2N2O2/c19-9-1-4-17(24)13(5-9)16-7-11(14(8-22)18(25)23-16)12-6-10(20)2-3-15(12)21/h1-7,24H,(H,23,25)
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n/an/an/a 810n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209198
PNG
(CHEMBL234041 | N-(5-chloro-3-(4-(2-chloro-5-(trifl...)
Show SMILES COC1CCC(CC1)C(=O)N(C)Cc1cc(Cl)cc(c1O)-c1cc(-c2cc(ccc2Cl)C(F)(F)F)c(C#N)c(=O)[nH]1 |(1.17,-33.82,;-.16,-33.05,;-1.49,-33.82,;-1.5,-35.36,;-2.83,-36.13,;-4.16,-35.36,;-4.17,-33.82,;-2.83,-33.05,;-5.49,-36.14,;-6.82,-35.37,;-5.48,-37.68,;-4.15,-38.44,;-6.81,-38.45,;-6.81,-39.99,;-8.14,-40.76,;-8.14,-42.31,;-9.47,-43.08,;-6.81,-43.08,;-5.47,-42.31,;-5.47,-40.76,;-4.14,-39.98,;-4.13,-43.07,;-4.14,-44.62,;-2.81,-45.38,;-2.81,-46.92,;-1.47,-47.68,;-1.46,-49.21,;-2.8,-49.99,;-4.14,-49.22,;-4.14,-47.69,;-5.47,-46.91,;-.13,-49.98,;1.2,-50.74,;.64,-48.64,;-.88,-51.32,;-1.47,-44.61,;-.14,-45.38,;1.19,-46.15,;-1.48,-43.06,;-.15,-42.29,;-2.81,-42.3,)|
Show InChI InChI=1S/C29H26Cl2F3N3O4/c1-37(28(40)15-3-6-19(41-2)7-4-15)14-16-9-18(30)11-22(26(16)38)25-12-20(23(13-35)27(39)36-25)21-10-17(29(32,33)34)5-8-24(21)31/h5,8-12,15,19,38H,3-4,6-7,14H2,1-2H3,(H,36,39)
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n/an/an/a 200n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209183
PNG
(CHEMBL396856 | N-(5-chloro-3-(4-(2-chloro-5-(trifl...)
Show SMILES CCCCCN1CCC(CC1)C(=O)N(C)Cc1cc(Cl)cc(c1O)-c1cc(-c2cc(ccc2Cl)C(F)(F)F)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C32H33Cl2F3N4O3/c1-3-4-5-10-41-11-8-19(9-12-41)31(44)40(2)18-20-13-22(33)15-25(29(20)42)28-16-23(26(17-38)30(43)39-28)24-14-21(32(35,36)37)6-7-27(24)34/h6-7,13-16,19,42H,3-5,8-12,18H2,1-2H3,(H,39,43)
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n/an/an/a 220n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50024762
PNG
(CHEMBL395633)
Show SMILES Clc1cccc(Nc2ccc3ccccc3c2)c1
Show InChI InChI=1S/C16H12ClN/c17-14-6-3-7-15(11-14)18-16-9-8-12-4-1-2-5-13(12)10-16/h1-11,18H
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n/an/an/a<1.00E+4n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50024761
PNG
(CHEMBL232200)
Show SMILES CC1(C)NC(=O)N(C\C(COc2ccc(cc2)-c2ccc(OC(F)(F)F)cc2)=N\O)C1=O
Show InChI InChI=1S/C21H20F3N3O5/c1-20(2)18(28)27(19(29)25-20)11-15(26-30)12-31-16-7-3-13(4-8-16)14-5-9-17(10-6-14)32-21(22,23)24/h3-10,30H,11-12H2,1-2H3,(H,25,29)/b26-15-
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n/an/an/a<1.00E+4n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209186
PNG
(1-(4-chlorophenyl)-1H-indole | CHEMBL233218)
Show SMILES Clc1ccc(cc1)-n1ccc2ccccc12
Show InChI InChI=1S/C14H10ClN/c15-12-5-7-13(8-6-12)16-10-9-11-3-1-2-4-14(11)16/h1-10H
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n/an/an/a 5.00E+3n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209184
PNG
(4-(2,5-dichlorophenyl)-6-(2-hydroxy-5-isobutylphen...)
Show SMILES CC(C)Cc1ccc(O)c(c1)-c1cc(-c2cc(Cl)ccc2Cl)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C22H18Cl2N2O2/c1-12(2)7-13-3-6-21(27)17(8-13)20-10-15(18(11-25)22(28)26-20)16-9-14(23)4-5-19(16)24/h3-6,8-10,12,27H,7H2,1-2H3,(H,26,28)
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n/an/an/a 7.56E+3n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209185
PNG
(6-(5-chloro-2-hydroxyphenyl)-4-(2-chloro-5-(triflu...)
Show SMILES Oc1ccc(Cl)cc1-c1cc(-c2cc(ccc2Cl)C(F)(F)F)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C19H9Cl2F3N2O2/c20-10-2-4-17(27)13(6-10)16-7-11(14(8-25)18(28)26-16)12-5-9(19(22,23)24)1-3-15(12)21/h1-7,27H,(H,26,28)
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n/an/an/a 520n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM26673
PNG
(6-(5-bromo-2-hydroxyphenyl)-2-oxo-4-phenyl-1,2-dih...)
Show SMILES Oc1ccc(Br)cc1-c1cc(-c2ccccc2)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C18H11BrN2O2/c19-12-6-7-17(22)14(8-12)16-9-13(11-4-2-1-3-5-11)15(10-20)18(23)21-16/h1-9,22H,(H,21,23)
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n/an/an/a 5.00E+3n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209197
PNG
(6-(5-cyclohexyl-2-hydroxyphenyl)-4-(2,5-dichloroph...)
Show SMILES Oc1ccc(cc1-c1cc(-c2cc(Cl)ccc2Cl)c(C#N)c(=O)[nH]1)C1CCCCC1
Show InChI InChI=1S/C24H20Cl2N2O2/c25-16-7-8-21(26)18(11-16)17-12-22(28-24(30)20(17)13-27)19-10-15(6-9-23(19)29)14-4-2-1-3-5-14/h6-12,14,29H,1-5H2,(H,28,30)
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n/an/an/a 2.98E+3n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209204
PNG
(CHEMBL234040 | N-(5-chloro-3-(4-(2-chloro-5-(trifl...)
Show SMILES CN(Cc1cc(Cl)cc(c1O)-c1cc(-c2cc(ccc2Cl)C(F)(F)F)c(C#N)c(=O)[nH]1)C(=O)CCN1CCOCC1
Show InChI InChI=1S/C28H25Cl2F3N4O4/c1-36(25(38)4-5-37-6-8-41-9-7-37)15-16-10-18(29)12-21(26(16)39)24-13-19(22(14-34)27(40)35-24)20-11-17(28(31,32)33)2-3-23(20)30/h2-3,10-13,39H,4-9,15H2,1H3,(H,35,40)
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n/an/an/a 76n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209180
PNG
(6-(5-bromo-2-hydroxyphenyl)-4-(2-chloro-5-(trifluo...)
Show SMILES Oc1ccc(Br)cc1-c1cc(-c2cc(ccc2Cl)C(F)(F)F)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C19H9BrClF3N2O2/c20-10-2-4-17(27)13(6-10)16-7-11(14(8-25)18(28)26-16)12-5-9(19(22,23)24)1-3-15(12)21/h1-7,27H,(H,26,28)
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n/an/an/a 490n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209201
PNG
(CHEMBL233848 | N-(5-chloro-3-(4-(2-chloro-5-(trifl...)
Show SMILES CC(=O)N1CCC(CC1)C(=O)NCc1cc(Cl)cc(c1O)-c1cc(-c2cc(ccc2Cl)C(F)(F)F)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C28H23Cl2F3N4O4/c1-14(38)37-6-4-15(5-7-37)26(40)35-13-16-8-18(29)10-21(25(16)39)24-11-19(22(12-34)27(41)36-24)20-9-17(28(31,32)33)2-3-23(20)30/h2-3,8-11,15,39H,4-7,13H2,1H3,(H,35,40)(H,36,41)
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n/an/an/a 48n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209187
PNG
(CHEMBL428195 | N-(5-chloro-3-(4-(2-chloro-5-(trifl...)
Show SMILES CN(Cc1cc(Cl)cc(c1O)-c1cc(-c2cc(ccc2Cl)C(F)(F)F)c(C#N)c(=O)[nH]1)C(=O)CCN1CCCC1
Show InChI InChI=1S/C28H25Cl2F3N4O3/c1-36(25(38)6-9-37-7-2-3-8-37)15-16-10-18(29)12-21(26(16)39)24-13-19(22(14-34)27(40)35-24)20-11-17(28(31,32)33)4-5-23(20)30/h4-5,10-13,39H,2-3,6-9,15H2,1H3,(H,35,40)
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n/an/an/a 440n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209194
PNG
(CHEMBL234358 | N-(5-chloro-3-(4-(2-chloro-5-(trifl...)
Show SMILES CCCN1CCC(CC1)C(=O)N(C)Cc1cc(Cl)cc(c1O)-c1cc(-c2cc(ccc2Cl)C(F)(F)F)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C30H29Cl2F3N4O3/c1-3-8-39-9-6-17(7-10-39)29(42)38(2)16-18-11-20(31)13-23(27(18)40)26-14-21(24(15-36)28(41)37-26)22-12-19(30(33,34)35)4-5-25(22)32/h4-5,11-14,17,40H,3,6-10,16H2,1-2H3,(H,37,41)
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n/an/an/a 37n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209205
PNG
(CHEMBL277554 | N-(4-methylpyridin-2-yl)piperidine-...)
Show SMILES Cc1ccnc(NC(=O)C2CCNCC2)c1
Show InChI InChI=1S/C12H17N3O/c1-9-2-7-14-11(8-9)15-12(16)10-3-5-13-6-4-10/h2,7-8,10,13H,3-6H2,1H3,(H,14,15,16)
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n/an/an/a 1.30E+5n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209181
PNG
(3-(3-bromophenyl)quinoline | CHEMBL397092)
Show SMILES Brc1cccc(c1)-c1cnc2ccccc2c1
Show InChI InChI=1S/C15H10BrN/c16-14-6-3-5-11(9-14)13-8-12-4-1-2-7-15(12)17-10-13/h1-10H
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n/an/an/a 1.00E+4n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209199
PNG
(6-(5-bromo-2-hydroxyphenyl)-4-(2,4-dimethylphenyl)...)
Show SMILES Cc1ccc(c(C)c1)-c1cc([nH]c(=O)c1C#N)-c1cc(Br)ccc1O
Show InChI InChI=1S/C20H15BrN2O2/c1-11-3-5-14(12(2)7-11)15-9-18(23-20(25)17(15)10-22)16-8-13(21)4-6-19(16)24/h3-9,24H,1-2H3,(H,23,25)
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n/an/an/a 700n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209206
PNG
((2-ethylbenzofuran-3-yl)(4-hydroxy-3,5-diiodopheny...)
Show SMILES CCc1oc2ccccc2c1C(=O)c1cc(I)c(O)c(I)c1
Show InChI InChI=1S/C17H12I2O3/c1-2-13-15(10-5-3-4-6-14(10)22-13)16(20)9-7-11(18)17(21)12(19)8-9/h3-8,21H,2H2,1H3
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n/an/an/a 8.00E+3n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM26673
PNG
(6-(5-bromo-2-hydroxyphenyl)-2-oxo-4-phenyl-1,2-dih...)
Show SMILES Oc1ccc(Br)cc1-c1cc(-c2ccccc2)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C18H11BrN2O2/c19-12-6-7-17(22)14(8-12)16-9-13(11-4-2-1-3-5-11)15(10-20)18(23)21-16/h1-9,22H,(H,21,23)
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n/an/an/a 5.70E+3n/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of survivin


Eur J Med Chem 45: 90-7 (2010)


Article DOI: 10.1016/j.ejmech.2009.09.029
BindingDB Entry DOI: 10.7270/Q20K28N2
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209209
PNG
(6-(5-bromo-2-hydroxyphenyl)-4-(2,5-dichlorophenyl)...)
Show SMILES Oc1ccc(Br)cc1-c1cc(-c2cc(Cl)ccc2Cl)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C18H9BrCl2N2O2/c19-9-1-4-17(24)13(5-9)16-7-11(14(8-22)18(25)23-16)12-6-10(20)2-3-15(12)21/h1-7,24H,(H,23,25)
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n/an/an/a 800n/an/an/an/an/a



German University in Cairo

Curated by ChEMBL


Assay Description
Inhibition of survivin


Eur J Med Chem 45: 90-7 (2010)


Article DOI: 10.1016/j.ejmech.2009.09.029
BindingDB Entry DOI: 10.7270/Q20K28N2
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50550143
PNG
(CHEMBL4793552)
Show SMILES CCCN1CCC(CC1)C(=O)N(C)Cc1cc(Cl)cc(c1O)-c1cc(-c2cc(ccc2I)C(F)(F)F)c(C#N)c(=O)[nH]1
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n/an/an/a 34n/an/an/an/an/a


TBA

Assay Description
Binding affinity to recombinant full length N-terminal GST-tagged human survivin expressed in Escherichia coli BL21 incubated for 1 hr under shaking ...


Citation and Details

Article DOI: 10.1016/j.bmcl.2015.12.046
BindingDB Entry DOI: 10.7270/Q2XD159M
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209194
PNG
(CHEMBL234358 | N-(5-chloro-3-(4-(2-chloro-5-(trifl...)
Show SMILES CCCN1CCC(CC1)C(=O)N(C)Cc1cc(Cl)cc(c1O)-c1cc(-c2cc(ccc2Cl)C(F)(F)F)c(C#N)c(=O)[nH]1
Show InChI InChI=1S/C30H29Cl2F3N4O3/c1-3-8-39-9-6-17(7-10-39)29(42)38(2)16-18-11-20(31)13-23(27(18)40)26-14-21(24(15-36)28(41)37-26)22-12-19(30(33,34)35)4-5-25(22)32/h4-5,11-14,17,40H,3,6-10,16H2,1-2H3,(H,37,41)
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n/an/an/a 44n/an/an/an/an/a


TBA

Assay Description
Binding affinity to recombinant full length N-terminal GST-tagged human survivin expressed in Escherichia coli BL21 incubated for 1 hr under shaking ...


Citation and Details

Article DOI: 10.1016/j.bmcl.2015.12.046
BindingDB Entry DOI: 10.7270/Q2XD159M
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209182
PNG
(CHEMBL234421 | N-(5-chloro-3-(4-(2-chloro-5-(trifl...)
Show SMILES CN(Cc1cc(Cl)cc(c1O)-c1cc(-c2cc(ccc2Cl)C(F)(F)F)c(C#N)c(=O)[nH]1)C(=O)C1CCN(CC1)C(=O)C1CCCCC1
Show InChI InChI=1S/C34H33Cl2F3N4O4/c1-42(32(46)20-9-11-43(12-10-20)33(47)19-5-3-2-4-6-19)18-21-13-23(35)15-26(30(21)44)29-16-24(27(17-40)31(45)41-29)25-14-22(34(37,38)39)7-8-28(25)36/h7-8,13-16,19-20,44H,2-6,9-12,18H2,1H3,(H,41,45)
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair
Baculoviral IAP repeat-containing protein 5


(Homo sapiens (Human))
BDBM50209208
PNG
(CHEMBL232404 | N-(5-chloro-3-(4-(2-chloro-5-(trifl...)
Show SMILES CN(Cc1cc(Cl)cc(c1O)-c1cc(-c2cc(ccc2Cl)C(F)(F)F)c(C#N)c(=O)[nH]1)C(=O)C1CCN(CC1)C(C)=O
Show InChI InChI=1S/C29H25Cl2F3N4O4/c1-15(39)38-7-5-16(6-8-38)28(42)37(2)14-17-9-19(30)11-22(26(17)40)25-12-20(23(13-35)27(41)36-25)21-10-18(29(32,33)34)3-4-24(21)31/h3-4,9-12,16,40H,5-8,14H2,1-2H3,(H,36,41)
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n/an/an/a 86n/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human survivin expressed in Escherichia coli BL21 cells after 30 mins


Bioorg Med Chem Lett 17: 3122-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.042
BindingDB Entry DOI: 10.7270/Q2M04534
More data for this
Ligand-Target Pair