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PubMed code 23767404

Compile data set for download or QSAR
Found 97 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
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM21447
PNG
(4-(4-{[2-(4-chlorophenyl)phenyl]methyl}piperazin-1...)
Show SMILES CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1 |r|
Show InChI InChI=1S/C42H45ClN6O5S2/c1-46(2)23-22-35(30-55-37-9-4-3-5-10-37)44-40-21-20-38(28-41(40)49(51)52)56(53,54)45-42(50)32-14-18-36(19-15-32)48-26-24-47(25-27-48)29-33-8-6-7-11-39(33)31-12-16-34(43)17-13-31/h3-21,28,35,44H,22-27,29-30H2,1-2H3,(H,45,50)/t35-/m1/s1
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n/an/a 0.5n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436680
PNG
(CHEMBL2398255)
Show SMILES OC(=O)c1cccc(n1)-c1ccc2NCCC(=NNc3nc4ccccc4s3)c2c1 |w:17.18|
Show InChI InChI=1S/C22H17N5O2S/c28-21(29)19-6-3-5-15(24-19)13-8-9-16-14(12-13)17(10-11-23-16)26-27-22-25-18-4-1-2-7-20(18)30-22/h1-9,12,23H,10-11H2,(H,25,27)(H,28,29)
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n/an/a 6n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Apoptosis regulator Bcl-2


(Homo sapiens (Human))		BDBM21447
PNG
(4-(4-{[2-(4-chlorophenyl)phenyl]methyl}piperazin-1...)
Show SMILES CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1 |r|
Show InChI InChI=1S/C42H45ClN6O5S2/c1-46(2)23-22-35(30-55-37-9-4-3-5-10-37)44-40-21-20-38(28-41(40)49(51)52)56(53,54)45-42(50)32-14-18-36(19-15-32)48-26-24-47(25-27-48)29-33-8-6-7-11-39(33)31-12-16-34(43)17-13-31/h3-21,28,35,44H,22-27,29-30H2,1-2H3,(H,45,50)/t35-/m1/s1
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n/an/a 7n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to Bcl-2 (unknown origin) by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436679
PNG
(CHEMBL2398250)
Show SMILES OC(=O)c1cccc(n1)-c1ccc2CCCCC(=NNc3nc4ccccc4s3)c2c1 |w:18.19|
Show InChI InChI=1S/C24H20N4O2S/c29-23(30)21-10-5-9-18(25-21)16-13-12-15-6-1-2-7-19(17(15)14-16)27-28-24-26-20-8-3-4-11-22(20)31-24/h3-5,8-14H,1-2,6-7H2,(H,26,28)(H,29,30)
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n/an/a 10n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM109233
PNG
(2-(8-(2-(Benzothiazol-2-yl)hydrazono)-5,6,7,8-tetr...)
Show SMILES OC(=O)c1csc(n1)-c1ccc2CCCC(=NNc3nc4ccccc4s3)c2c1 |w:16.17|
Show InChI InChI=1S/C21H16N4O2S2/c26-20(27)17-11-28-19(22-17)13-9-8-12-4-3-6-15(14(12)10-13)24-25-21-23-16-5-1-2-7-18(16)29-21/h1-2,5,7-11H,3-4,6H2,(H,23,25)(H,26,27)
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n/an/a 13n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM21447
PNG
(4-(4-{[2-(4-chlorophenyl)phenyl]methyl}piperazin-1...)
Show SMILES CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1 |r|
Show InChI InChI=1S/C42H45ClN6O5S2/c1-46(2)23-22-35(30-55-37-9-4-3-5-10-37)44-40-21-20-38(28-41(40)49(51)52)56(53,54)45-42(50)32-14-18-36(19-15-32)48-26-24-47(25-27-48)29-33-8-6-7-11-39(33)31-12-16-34(43)17-13-31/h3-21,28,35,44H,22-27,29-30H2,1-2H3,(H,45,50)/t35-/m1/s1
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n/an/a 14n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436678
PNG
(CHEMBL2398254)
Show SMILES OC(=O)c1cccc(n1)-c1ccc2SCCC(=NNc3nc4ccccc4s3)c2c1 |w:17.18|
Show InChI InChI=1S/C22H16N4O2S2/c27-21(28)18-6-3-5-15(23-18)13-8-9-19-14(12-13)16(10-11-29-19)25-26-22-24-17-4-1-2-7-20(17)30-22/h1-9,12H,10-11H2,(H,24,26)(H,27,28)
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n/an/a 14n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436677
PNG
(CHEMBL2398252)
Show SMILES CC1CC(=NNc2nc3ccccc3s2)c2cc(ccc2C1)-c1cccc(n1)C(O)=O |w:4.4|
Show InChI InChI=1S/C24H20N4O2S/c1-14-11-15-9-10-16(18-6-4-7-20(25-18)23(29)30)13-17(15)21(12-14)27-28-24-26-19-5-2-3-8-22(19)31-24/h2-10,13-14H,11-12H2,1H3,(H,26,28)(H,29,30)
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n/an/a 17n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM109232
PNG
(6-(8-(2-(Benzothiazol-2-yl)hydrazono)-5,6,7,8-tetr...)
Show SMILES OC(=O)c1cccc(n1)-c1ccc2CCCC(=NNc3nc4ccccc4s3)c2c1 |w:17.18|
Show InChI InChI=1S/C23H18N4O2S/c28-22(29)20-9-4-7-17(24-20)15-12-11-14-5-3-8-18(16(14)13-15)26-27-23-25-19-6-1-2-10-21(19)30-23/h1-2,4,6-7,9-13H,3,5,8H2,(H,25,27)(H,28,29)
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n/an/a 20n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM109232
PNG
(6-(8-(2-(Benzothiazol-2-yl)hydrazono)-5,6,7,8-tetr...)
Show SMILES OC(=O)c1cccc(n1)-c1ccc2CCCC(=NNc3nc4ccccc4s3)c2c1 |w:17.18|
Show InChI InChI=1S/C23H18N4O2S/c28-22(29)20-9-4-7-17(24-20)15-12-11-14-5-3-8-18(16(14)13-15)26-27-23-25-19-6-1-2-10-21(19)30-23/h1-2,4,6-7,9-13H,3,5,8H2,(H,25,27)(H,28,29)
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n/an/a 23n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM109233
PNG
(2-(8-(2-(Benzothiazol-2-yl)hydrazono)-5,6,7,8-tetr...)
Show SMILES OC(=O)c1csc(n1)-c1ccc2CCCC(=NNc3nc4ccccc4s3)c2c1 |w:16.17|
Show InChI InChI=1S/C21H16N4O2S2/c26-20(27)17-11-28-19(22-17)13-9-8-12-4-3-6-15(14(12)10-13)24-25-21-23-16-5-1-2-7-18(16)29-21/h1-2,5,7-11H,3-4,6H2,(H,23,25)(H,26,27)
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n/an/a 24n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436628
PNG
(CHEMBL2398263)
Show SMILES OC(=O)c1cc(ccn1)-c1ccc2CCCC(=NNc3nc4ccccc4s3)c2c1 |w:17.18|
Show InChI InChI=1S/C23H18N4O2S/c28-22(29)20-13-16(10-11-24-20)15-9-8-14-4-3-6-18(17(14)12-15)26-27-23-25-19-5-1-2-7-21(19)30-23/h1-2,5,7-13H,3-4,6H2,(H,25,27)(H,28,29)
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n/an/a 41n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436676
PNG
(CHEMBL2398257)
Show SMILES CC1CCC(=NNc2nc3ccccc3s2)c2cc(ccc12)-c1cccc(n1)C(O)=O |w:5.5|
Show InChI InChI=1S/C24H20N4O2S/c1-14-9-12-19(27-28-24-26-20-5-2-3-8-22(20)31-24)17-13-15(10-11-16(14)17)18-6-4-7-21(25-18)23(29)30/h2-8,10-11,13-14H,9,12H2,1H3,(H,26,28)(H,29,30)
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n/an/a 47n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436646
PNG
(CHEMBL2398249)
Show SMILES CCN1CCC(=NNc2nc3ccccc3s2)c2cc(ccc12)-c1cccc(n1)C(O)=O |w:6.6|
Show InChI InChI=1S/C24H21N5O2S/c1-2-29-13-12-18(27-28-24-26-19-6-3-4-9-22(19)32-24)16-14-15(10-11-21(16)29)17-7-5-8-20(25-17)23(30)31/h3-11,14H,2,12-13H2,1H3,(H,26,28)(H,30,31)
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n/an/a 49n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436675
PNG
(CHEMBL2398258)
Show SMILES OC(=O)c1cccc(n1)-c1ccc2c(c1)C(CCS2=O)=NNc1nc2ccccc2s1 |w:20.23|
Show InChI InChI=1S/C22H16N4O3S2/c27-21(28)18-6-3-5-15(23-18)13-8-9-20-14(12-13)16(10-11-31(20)29)25-26-22-24-17-4-1-2-7-19(17)30-22/h1-9,12H,10-11H2,(H,24,26)(H,27,28)
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n/an/a 51n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436674
PNG
(CHEMBL2398253)
Show SMILES OC(=O)c1cccc(n1)-c1ccc2OCCC(=NNc3nc4ccccc4s3)c2c1 |w:17.18|
Show InChI InChI=1S/C22H16N4O3S/c27-21(28)18-6-3-5-15(23-18)13-8-9-19-14(12-13)16(10-11-29-19)25-26-22-24-17-4-1-2-7-20(17)30-22/h1-9,12H,10-11H2,(H,24,26)(H,27,28)
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n/an/a 55n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436673
PNG
(CHEMBL2398261)
Show SMILES OC(=O)c1coc(n1)-c1ccc2CCCC(=NNc3nc4ccccc4s3)c2c1 |w:16.17|
Show InChI InChI=1S/C21H16N4O3S/c26-20(27)17-11-28-19(22-17)13-9-8-12-4-3-6-15(14(12)10-13)24-25-21-23-16-5-1-2-7-18(16)29-21/h1-2,5,7-11H,3-4,6H2,(H,23,25)(H,26,27)
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n/an/a 60n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436628
PNG
(CHEMBL2398263)
Show SMILES OC(=O)c1cc(ccn1)-c1ccc2CCCC(=NNc3nc4ccccc4s3)c2c1 |w:17.18|
Show InChI InChI=1S/C23H18N4O2S/c28-22(29)20-13-16(10-11-24-20)15-9-8-14-4-3-6-18(17(14)12-15)26-27-23-25-19-5-1-2-7-21(19)30-23/h1-2,5,7-13H,3-4,6H2,(H,25,27)(H,28,29)
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n/an/a 60n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 2


(Homo sapiens (Human))		BDBM21447
PNG
(4-(4-{[2-(4-chlorophenyl)phenyl]methyl}piperazin-1...)
Show SMILES CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1 |r|
Show InChI InChI=1S/C42H45ClN6O5S2/c1-46(2)23-22-35(30-55-37-9-4-3-5-10-37)44-40-21-20-38(28-41(40)49(51)52)56(53,54)45-42(50)32-14-18-36(19-15-32)48-26-24-47(25-27-48)29-33-8-6-7-11-39(33)31-12-16-34(43)17-13-31/h3-21,28,35,44H,22-27,29-30H2,1-2H3,(H,45,50)/t35-/m1/s1
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n/an/a 66n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to Bcl-w (unknown origin) by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436645
PNG
(CHEMBL2398262)
Show SMILES OC(=O)c1ccnc(n1)-c1ccc2CCCC(=NNc3nc4ccccc4s3)c2c1 |w:17.18|
Show InChI InChI=1S/C22H17N5O2S/c28-21(29)18-10-11-23-20(24-18)14-9-8-13-4-3-6-16(15(13)12-14)26-27-22-25-17-5-1-2-7-19(17)30-22/h1-2,5,7-12H,3-4,6H2,(H,25,27)(H,28,29)
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n/an/a 77n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436672
PNG
(CHEMBL2398259)
Show SMILES OC(=O)c1cccc(n1)-c1ccc2c(c1)C(CCS2(=O)=O)=NNc1nc2ccccc2s1 |w:21.24|
Show InChI InChI=1S/C22H16N4O4S2/c27-21(28)18-6-3-5-15(23-18)13-8-9-20-14(12-13)16(10-11-32(20,29)30)25-26-22-24-17-4-1-2-7-19(17)31-22/h1-9,12H,10-11H2,(H,24,26)(H,27,28)
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n/an/a 78n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436646
PNG
(CHEMBL2398249)
Show SMILES CCN1CCC(=NNc2nc3ccccc3s2)c2cc(ccc12)-c1cccc(n1)C(O)=O |w:6.6|
Show InChI InChI=1S/C24H21N5O2S/c1-2-29-13-12-18(27-28-24-26-19-6-3-4-9-22(19)32-24)16-14-15(10-11-21(16)29)17-7-5-8-20(25-17)23(30)31/h3-11,14H,2,12-13H2,1H3,(H,26,28)(H,30,31)
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n/an/a 88n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436671
PNG
(CHEMBL2398256)
Show SMILES CC1(C)CC(=NNc2nc3ccccc3s2)c2cc(ccc2O1)-c1cccc(n1)C(O)=O |w:5.5|
Show InChI InChI=1S/C24H20N4O3S/c1-24(2)13-19(27-28-23-26-17-6-3-4-9-21(17)32-23)15-12-14(10-11-20(15)31-24)16-7-5-8-18(25-16)22(29)30/h3-12H,13H2,1-2H3,(H,26,28)(H,29,30)
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n/an/a 100n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436648
PNG
(CHEMBL2398286)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1cccc(c1)-c1cccc(n1)C(O)=O |w:3.3|
Show InChI InChI=1S/C21H16N4O2S/c1-13(24-25-21-23-17-8-2-3-11-19(17)28-21)14-6-4-7-15(12-14)16-9-5-10-18(22-16)20(26)27/h2-13H,1H3,(H,26,27)
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n/an/a 120n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436670
PNG
(CHEMBL2398172)
Show SMILES OC(=O)c1cccc(n1)-c1ccc2CCC(=NNc3nc4ccccc4s3)c2c1 |w:16.17|
Show InChI InChI=1S/C22H16N4O2S/c27-21(28)19-6-3-5-16(23-19)14-9-8-13-10-11-17(15(13)12-14)25-26-22-24-18-4-1-2-7-20(18)29-22/h1-9,12H,10-11H2,(H,24,26)(H,27,28)
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n/an/a 130n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436648
PNG
(CHEMBL2398286)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1cccc(c1)-c1cccc(n1)C(O)=O |w:3.3|
Show InChI InChI=1S/C21H16N4O2S/c1-13(24-25-21-23-17-8-2-3-11-19(17)28-21)14-6-4-7-15(12-14)16-9-5-10-18(22-16)20(26)27/h2-13H,1H3,(H,26,27)
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n/an/a 140n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436669
PNG
(CHEMBL2398289)
Show SMILES [O-][N+](=O)c1cc(ccc1N[C@@H](CSc1ccccc1)CC(=O)N1CCOCC1)S(=O)(=O)NC(=O)c1ccc(cc1)-c1ccc(F)cc1 |r|
Show InChI InChI=1S/C33H31FN4O7S2/c34-26-12-10-24(11-13-26)23-6-8-25(9-7-23)33(40)36-47(43,44)29-14-15-30(31(21-29)38(41)42)35-27(22-46-28-4-2-1-3-5-28)20-32(39)37-16-18-45-19-17-37/h1-15,21,27,35H,16-20,22H2,(H,36,40)/t27-/m1/s1
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n/an/a 150n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436668
PNG
(CHEMBL2398251)
Show SMILES CC1CCc2ccc(cc2C1=NNc1nc2ccccc2s1)-c1cccc(n1)C(O)=O |w:11.13|
Show InChI InChI=1S/C24H20N4O2S/c1-14-9-10-15-11-12-16(18-6-4-7-20(25-18)23(29)30)13-17(15)22(14)27-28-24-26-19-5-2-3-8-21(19)31-24/h2-8,11-14H,9-10H2,1H3,(H,26,28)(H,29,30)
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n/an/a 260n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436645
PNG
(CHEMBL2398262)
Show SMILES OC(=O)c1ccnc(n1)-c1ccc2CCCC(=NNc3nc4ccccc4s3)c2c1 |w:17.18|
Show InChI InChI=1S/C22H17N5O2S/c28-21(29)18-10-11-23-20(24-18)14-9-8-13-4-3-6-16(15(13)12-14)26-27-22-25-17-5-1-2-7-19(17)30-22/h1-2,5,7-12H,3-4,6H2,(H,25,27)(H,28,29)
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n/an/a 340n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436626
PNG
(CHEMBL2398170)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1ccc(s1)-c1cccc(n1)C(O)=O |w:3.3|
Show InChI InChI=1S/C19H14N4O2S2/c1-11(22-23-19-21-13-5-2-3-8-16(13)27-19)15-9-10-17(26-15)12-6-4-7-14(20-12)18(24)25/h2-11H,1H3,(H,24,25)
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n/an/a 750n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436667
PNG
(CHEMBL2398283)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1ccc(-c2ccc(Cl)c(c2)C(O)=O)n1C |w:3.3|
Show InChI InChI=1S/C21H17ClN4O2S/c1-12(24-25-21-23-16-5-3-4-6-19(16)29-21)17-9-10-18(26(17)2)13-7-8-15(22)14(11-13)20(27)28/h3-12H,1-2H3,(H,27,28)
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n/an/a 1.10E+3n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436626
PNG
(CHEMBL2398170)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1ccc(s1)-c1cccc(n1)C(O)=O |w:3.3|
Show InChI InChI=1S/C19H14N4O2S2/c1-11(22-23-19-21-13-5-2-3-8-16(13)27-19)15-9-10-17(26-15)12-6-4-7-14(20-12)18(24)25/h2-11H,1H3,(H,24,25)
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n/an/a 1.20E+3n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436666
PNG
(CHEMBL2398285)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1cccc(c1)-c1ccc(o1)C(O)=O |w:3.3|
Show InChI InChI=1S/C20H15N3O3S/c1-12(22-23-20-21-15-7-2-3-8-18(15)27-20)13-5-4-6-14(11-13)16-9-10-17(26-16)19(24)25/h2-12H,1H3,(H,24,25)
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n/an/a 1.30E+3n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436664
PNG
(CHEMBL2398284)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1ccc([nH]1)-c1ccc(Cl)c(c1)C(O)=O |w:3.3|
Show InChI InChI=1S/C20H15ClN4O2S/c1-11(24-25-20-23-17-4-2-3-5-18(17)28-20)15-8-9-16(22-15)12-6-7-14(21)13(10-12)19(26)27/h2-11,22H,1H3,(H,26,27)
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n/an/a 1.50E+3n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436665
PNG
(CHEMBL2398265)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1ccc(o1)-c1cccc(C(O)=O)c1C |w:3.3|
Show InChI InChI=1S/C21H17N3O3S/c1-12-14(6-5-7-15(12)20(25)26)18-11-10-17(27-18)13(2)23-24-21-22-16-8-3-4-9-19(16)28-21/h3-11,13H,1-2H3,(H,25,26)
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n/an/a 1.50E+3n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436663
PNG
(CHEMBL2398282)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1ccc(s1)-c1ccc(Cl)c(c1)C(O)=O |w:3.3|
Show InChI InChI=1S/C20H14ClN3O2S2/c1-11(23-24-20-22-15-4-2-3-5-18(15)28-20)16-8-9-17(27-16)12-6-7-14(21)13(10-12)19(25)26/h2-11H,1H3,(H,25,26)
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n/an/a 1.60E+3n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436661
PNG
(CHEMBL2398171)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1ccc(s1)-c1ccc(o1)C(O)=O |w:3.3|
Show InChI InChI=1S/C18H13N3O3S2/c1-10(20-21-18-19-11-4-2-3-5-15(11)26-18)14-8-9-16(25-14)12-6-7-13(24-12)17(22)23/h2-10H,1H3,(H,22,23)
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n/an/a 1.70E+3n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436662
PNG
(CHEMBL2398296)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1ccc(o1)-c1ccc(Cl)c(c1)C(O)=O |w:3.3|
Show InChI InChI=1S/C20H14ClN3O3S/c1-11(23-24-20-22-15-4-2-3-5-18(15)28-20)16-8-9-17(27-16)12-6-7-14(21)13(10-12)19(25)26/h2-11H,1H3,(H,25,26)
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n/an/a 1.70E+3n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436660
PNG
(CHEMBL2398266)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1ccc(o1)-c1ccc(c(c1)C(O)=O)[N+]([O-])=O |w:3.3|
Show InChI InChI=1S/C20H14N4O5S/c1-11(22-23-20-21-14-4-2-3-5-18(14)30-20)16-8-9-17(29-16)12-6-7-15(24(27)28)13(10-12)19(25)26/h2-11H,1H3,(H,25,26)
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n/an/a 1.80E+3n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436659
PNG
(CHEMBL2398264)
Show SMILES OC(=O)c1cccc(n1)-c1cccc2C(CCc12)=NNc1nc2ccccc2s1 |w:18.21|
Show InChI InChI=1S/C22H16N4O2S/c27-21(28)19-9-4-8-16(23-19)14-5-3-6-15-13(14)11-12-17(15)25-26-22-24-18-7-1-2-10-20(18)29-22/h1-10H,11-12H2,(H,24,26)(H,27,28)
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n/an/a 2.00E+3n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50181876
PNG
(CHEMBL371861 | N-(4'-fluoro-biphenyl-4-carbonyl)-3...)
Show SMILES [O-][N+](=O)c1cc(ccc1NCCSc1ccccc1)S(=O)(=O)NC(=O)c1ccc(cc1)-c1ccc(F)cc1
Show InChI InChI=1S/C27H22FN3O5S2/c28-22-12-10-20(11-13-22)19-6-8-21(9-7-19)27(32)30-38(35,36)24-14-15-25(26(18-24)31(33)34)29-16-17-37-23-4-2-1-3-5-23/h1-15,18,29H,16-17H2,(H,30,32)
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n/an/a 2.20E+3n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436643
PNG
(3-(5-(1-(2-(Benzo[d]thiazol-2-yl)hydrazono)ethyl)f...)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1ccc(o1)-c1cccc(c1)C(O)=O |w:3.3|
Show InChI InChI=1S/C20H15N3O3S/c1-12(22-23-20-21-15-7-2-3-8-18(15)27-20)16-9-10-17(26-16)13-5-4-6-14(11-13)19(24)25/h2-12H,1H3,(H,24,25)
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n/an/a 2.20E+3n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436658
PNG
(CHEMBL2398297)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1ccc(o1)-c1cccc(C(O)=O)c1Cl |w:3.3|
Show InChI InChI=1S/C20H14ClN3O3S/c1-11(23-24-20-22-14-7-2-3-8-17(14)28-20)15-9-10-16(27-15)12-5-4-6-13(18(12)21)19(25)26/h2-11H,1H3,(H,25,26)
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n/an/a 2.70E+3n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436657
PNG
(CHEMBL2398288)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1cccc(c1)-c1cncc(n1)C(O)=O |w:3.3|
Show InChI InChI=1S/C20H15N5O2S/c1-12(24-25-20-23-15-7-2-3-8-18(15)28-20)13-5-4-6-14(9-13)16-10-21-11-17(22-16)19(26)27/h2-12H,1H3,(H,26,27)
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n/an/a 3.80E+3n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436656
PNG
(CHEMBL2398272)
Show SMILES CC(N=Nc1nc2ccc(F)cc2s1)c1ccc(o1)-c1ccc(Cl)c(c1)C(O)=O |w:3.3|
Show InChI InChI=1S/C20H13ClFN3O3S/c1-10(24-25-20-23-15-5-3-12(22)9-18(15)29-20)16-6-7-17(28-16)11-2-4-14(21)13(8-11)19(26)27/h2-10H,1H3,(H,26,27)
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n/an/a 4.00E+3n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Apoptosis regulator Bcl-2


(Homo sapiens (Human))		BDBM109233
PNG
(2-(8-(2-(Benzothiazol-2-yl)hydrazono)-5,6,7,8-tetr...)
Show SMILES OC(=O)c1csc(n1)-c1ccc2CCCC(=NNc3nc4ccccc4s3)c2c1 |w:16.17|
Show InChI InChI=1S/C21H16N4O2S2/c26-20(27)17-11-28-19(22-17)13-9-8-12-4-3-6-15(14(12)10-13)24-25-21-23-16-5-1-2-7-18(16)29-21/h1-2,5,7-11H,3-4,6H2,(H,23,25)(H,26,27)
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n/an/a 5.00E+3n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to Bcl-2 (unknown origin) by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 2


(Homo sapiens (Human))		BDBM50436628
PNG
(CHEMBL2398263)
Show SMILES OC(=O)c1cc(ccn1)-c1ccc2CCCC(=NNc3nc4ccccc4s3)c2c1 |w:17.18|
Show InChI InChI=1S/C23H18N4O2S/c28-22(29)20-13-16(10-11-24-20)15-9-8-14-4-3-6-18(17(14)12-15)26-27-23-25-19-5-1-2-7-21(19)30-23/h1-2,5,7-13H,3-4,6H2,(H,25,27)(H,28,29)
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n/an/a 5.00E+3n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to Bcl-w (unknown origin) by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Apoptosis regulator Bcl-2


(Homo sapiens (Human))		BDBM50436628
PNG
(CHEMBL2398263)
Show SMILES OC(=O)c1cc(ccn1)-c1ccc2CCCC(=NNc3nc4ccccc4s3)c2c1 |w:17.18|
Show InChI InChI=1S/C23H18N4O2S/c28-22(29)20-13-16(10-11-24-20)15-9-8-14-4-3-6-18(17(14)12-15)26-27-23-25-19-5-1-2-7-21(19)30-23/h1-2,5,7-13H,3-4,6H2,(H,25,27)(H,28,29)
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n/an/a 5.00E+3n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to Bcl-2 (unknown origin) by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 2


(Homo sapiens (Human))		BDBM109233
PNG
(2-(8-(2-(Benzothiazol-2-yl)hydrazono)-5,6,7,8-tetr...)
Show SMILES OC(=O)c1csc(n1)-c1ccc2CCCC(=NNc3nc4ccccc4s3)c2c1 |w:16.17|
Show InChI InChI=1S/C21H16N4O2S2/c26-20(27)17-11-28-19(22-17)13-9-8-12-4-3-6-15(14(12)10-13)24-25-21-23-16-5-1-2-7-18(16)29-21/h1-2,5,7-11H,3-4,6H2,(H,23,25)(H,26,27)
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n/an/a 5.00E+3n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to Bcl-w (unknown origin) by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436654
PNG
(CHEMBL2398277)
Show SMILES CC(N=Nc1nc2c(F)cccc2s1)c1ccc(o1)-c1ccc(Cl)c(c1)C(O)=O |w:3.3|
Show InChI InChI=1S/C20H13ClFN3O3S/c1-10(24-25-20-23-18-14(22)3-2-4-17(18)29-20)15-7-8-16(28-15)11-5-6-13(21)12(9-11)19(26)27/h2-10H,1H3,(H,26,27)
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n/an/a 5.20E+3n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436653
PNG
(CHEMBL2398294)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1ccc(o1)-c1ccccc1C(O)=O |w:3.3|
Show InChI InChI=1S/C20H15N3O3S/c1-12(22-23-20-21-15-8-4-5-9-18(15)27-20)16-10-11-17(26-16)13-6-2-3-7-14(13)19(24)25/h2-12H,1H3,(H,24,25)
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n/an/a 6.30E+3n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436652
PNG
(CHEMBL2398267)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1ccc(o1)-c1ccc(N)c(c1)C(O)=O |w:3.3|
Show InChI InChI=1S/C20H16N4O3S/c1-11(23-24-20-22-15-4-2-3-5-18(15)28-20)16-8-9-17(27-16)12-6-7-14(21)13(10-12)19(25)26/h2-11H,21H2,1H3,(H,25,26)
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n/an/a 6.70E+3n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436627
PNG
(CHEMBL2398290)
Show SMILES Cc1c(cccc1-c1ccc(CN=Nc2nc3ccccc3s2)o1)C(O)=O |w:13.14|
Show InChI InChI=1S/C20H15N3O3S/c1-12-14(5-4-6-15(12)19(24)25)17-10-9-13(26-17)11-21-23-20-22-16-7-2-3-8-18(16)27-20/h2-10H,11H2,1H3,(H,24,25)
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n/an/a 6.80E+3n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Displacement of biotinylated-Bak from Bcl-Xl (unknown origin) by fluorescence polarization assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436627
PNG
(CHEMBL2398290)
Show SMILES Cc1c(cccc1-c1ccc(CN=Nc2nc3ccccc3s2)o1)C(O)=O |w:13.14|
Show InChI InChI=1S/C20H15N3O3S/c1-12-14(5-4-6-15(12)19(24)25)17-10-9-13(26-17)11-21-23-20-22-16-7-2-3-8-18(16)27-20/h2-10H,11H2,1H3,(H,24,25)
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n/an/a 7.70E+3n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436651
PNG
(CHEMBL2398287)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1cccc(c1)-c1cncc(c1)C(O)=O |w:3.3|
Show InChI InChI=1S/C21H16N4O2S/c1-13(24-25-21-23-18-7-2-3-8-19(18)28-21)14-5-4-6-15(9-14)16-10-17(20(26)27)12-22-11-16/h2-13H,1H3,(H,26,27)
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n/an/a 8.10E+3n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436650
PNG
(CHEMBL2398274)
Show SMILES CC(N=Nc1nc2ccc(Br)cc2s1)c1ccc(o1)-c1ccc(Cl)c(c1)C(O)=O |w:3.3|
Show InChI InChI=1S/C20H13BrClN3O3S/c1-10(24-25-20-23-15-5-3-12(21)9-18(15)29-20)16-6-7-17(28-16)11-2-4-14(22)13(8-11)19(26)27/h2-10H,1H3,(H,26,27)
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n/an/a 9.30E+3n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Apoptosis regulator Bcl-2


(Homo sapiens (Human))		BDBM50436645
PNG
(CHEMBL2398262)
Show SMILES OC(=O)c1ccnc(n1)-c1ccc2CCCC(=NNc3nc4ccccc4s3)c2c1 |w:17.18|
Show InChI InChI=1S/C22H17N5O2S/c28-21(29)18-10-11-23-20(24-18)14-9-8-13-4-3-6-16(15(13)12-14)26-27-22-25-17-5-1-2-7-19(17)30-22/h1-2,5,7-12H,3-4,6H2,(H,25,27)(H,28,29)
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n/an/a>1.00E+4n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to Bcl-2 (unknown origin) by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Apoptosis regulator Bcl-2


(Homo sapiens (Human))		BDBM50436643
PNG
(3-(5-(1-(2-(Benzo[d]thiazol-2-yl)hydrazono)ethyl)f...)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1ccc(o1)-c1cccc(c1)C(O)=O |w:3.3|
Show InChI InChI=1S/C20H15N3O3S/c1-12(22-23-20-21-15-7-2-3-8-18(15)27-20)16-9-10-17(26-16)13-5-4-6-14(11-13)19(24)25/h2-12H,1H3,(H,24,25)
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n/an/a>1.00E+4n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to Bcl-2 (unknown origin) by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 2


(Homo sapiens (Human))		BDBM50436646
PNG
(CHEMBL2398249)
Show SMILES CCN1CCC(=NNc2nc3ccccc3s2)c2cc(ccc12)-c1cccc(n1)C(O)=O |w:6.6|
Show InChI InChI=1S/C24H21N5O2S/c1-2-29-13-12-18(27-28-24-26-19-6-3-4-9-22(19)32-24)16-14-15(10-11-21(16)29)17-7-5-8-20(25-17)23(30)31/h3-11,14H,2,12-13H2,1H3,(H,26,28)(H,30,31)
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n/an/a>1.00E+4n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to Bcl-w (unknown origin) by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Apoptosis regulator Bcl-2


(Homo sapiens (Human))		BDBM109232
PNG
(6-(8-(2-(Benzothiazol-2-yl)hydrazono)-5,6,7,8-tetr...)
Show SMILES OC(=O)c1cccc(n1)-c1ccc2CCCC(=NNc3nc4ccccc4s3)c2c1 |w:17.18|
Show InChI InChI=1S/C23H18N4O2S/c28-22(29)20-9-4-7-17(24-20)15-12-11-14-5-3-8-18(16(14)13-15)26-27-23-25-19-6-1-2-10-21(19)30-23/h1-2,4,6-7,9-13H,3,5,8H2,(H,25,27)(H,28,29)
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n/an/a>1.00E+4n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to Bcl-2 (unknown origin) by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 2


(Homo sapiens (Human))		BDBM109232
PNG
(6-(8-(2-(Benzothiazol-2-yl)hydrazono)-5,6,7,8-tetr...)
Show SMILES OC(=O)c1cccc(n1)-c1ccc2CCCC(=NNc3nc4ccccc4s3)c2c1 |w:17.18|
Show InChI InChI=1S/C23H18N4O2S/c28-22(29)20-9-4-7-17(24-20)15-12-11-14-5-3-8-18(16(14)13-15)26-27-23-25-19-6-1-2-10-21(19)30-23/h1-2,4,6-7,9-13H,3,5,8H2,(H,25,27)(H,28,29)
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n/an/a>1.00E+4n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to Bcl-w (unknown origin) by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 2


(Homo sapiens (Human))		BDBM50436643
PNG
(3-(5-(1-(2-(Benzo[d]thiazol-2-yl)hydrazono)ethyl)f...)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1ccc(o1)-c1cccc(c1)C(O)=O |w:3.3|
Show InChI InChI=1S/C20H15N3O3S/c1-12(22-23-20-21-15-7-2-3-8-18(15)27-20)16-9-10-17(26-16)13-5-4-6-14(11-13)19(24)25/h2-12H,1H3,(H,24,25)
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n/an/a>1.00E+4n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to Bcl-w (unknown origin) by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Apoptosis regulator Bcl-2


(Homo sapiens (Human))		BDBM50436626
PNG
(CHEMBL2398170)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1ccc(s1)-c1cccc(n1)C(O)=O |w:3.3|
Show InChI InChI=1S/C19H14N4O2S2/c1-11(22-23-19-21-13-5-2-3-8-16(13)27-19)15-9-10-17(26-15)12-6-4-7-14(20-12)18(24)25/h2-11H,1H3,(H,24,25)
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n/an/a>1.00E+4n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to Bcl-2 (unknown origin) by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 2


(Homo sapiens (Human))		BDBM50436645
PNG
(CHEMBL2398262)
Show SMILES OC(=O)c1ccnc(n1)-c1ccc2CCCC(=NNc3nc4ccccc4s3)c2c1 |w:17.18|
Show InChI InChI=1S/C22H17N5O2S/c28-21(29)18-10-11-23-20(24-18)14-9-8-13-4-3-6-16(15(13)12-14)26-27-22-25-17-5-1-2-7-19(17)30-22/h1-2,5,7-12H,3-4,6H2,(H,25,27)(H,28,29)
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n/an/a>1.00E+4n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to Bcl-w (unknown origin) by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Apoptosis regulator Bcl-2


(Homo sapiens (Human))		BDBM50436648
PNG
(CHEMBL2398286)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1cccc(c1)-c1cccc(n1)C(O)=O |w:3.3|
Show InChI InChI=1S/C21H16N4O2S/c1-13(24-25-21-23-17-8-2-3-11-19(17)28-21)14-6-4-7-15(12-14)16-9-5-10-18(22-16)20(26)27/h2-13H,1H3,(H,26,27)
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n/an/a>1.00E+4n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to Bcl-2 (unknown origin) by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436649
PNG
(CHEMBL2398291)
Show SMILES OC(=O)c1cccc(c1)-c1ccc(CN=Nc2nc3ccccc3s2)o1 |w:15.16|
Show InChI InChI=1S/C19H13N3O3S/c23-18(24)13-5-3-4-12(10-13)16-9-8-14(25-16)11-20-22-19-21-15-6-1-2-7-17(15)26-19/h1-10H,11H2,(H,23,24)
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n/an/a 1.00E+4n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 2


(Homo sapiens (Human))		BDBM50436626
PNG
(CHEMBL2398170)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1ccc(s1)-c1cccc(n1)C(O)=O |w:3.3|
Show InChI InChI=1S/C19H14N4O2S2/c1-11(22-23-19-21-13-5-2-3-8-16(13)27-19)15-9-10-17(26-15)12-6-4-7-14(20-12)18(24)25/h2-11H,1H3,(H,24,25)
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n/an/a>1.00E+4n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to Bcl-w (unknown origin) by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Apoptosis regulator Bcl-2


(Homo sapiens (Human))		BDBM50436646
PNG
(CHEMBL2398249)
Show SMILES CCN1CCC(=NNc2nc3ccccc3s2)c2cc(ccc12)-c1cccc(n1)C(O)=O |w:6.6|
Show InChI InChI=1S/C24H21N5O2S/c1-2-29-13-12-18(27-28-24-26-19-6-3-4-9-22(19)32-24)16-14-15(10-11-21(16)29)17-7-5-8-20(25-17)23(30)31/h3-11,14H,2,12-13H2,1H3,(H,26,28)(H,30,31)
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n/an/a>1.00E+4n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to Bcl-2 (unknown origin) by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 2


(Homo sapiens (Human))		BDBM50436648
PNG
(CHEMBL2398286)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1cccc(c1)-c1cccc(n1)C(O)=O |w:3.3|
Show InChI InChI=1S/C21H16N4O2S/c1-13(24-25-21-23-17-8-2-3-11-19(17)28-21)14-6-4-7-15(12-14)16-9-5-10-18(22-16)20(26)27/h2-13H,1H3,(H,26,27)
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n/an/a>1.00E+4n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to Bcl-w (unknown origin) by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436643
PNG
(3-(5-(1-(2-(Benzo[d]thiazol-2-yl)hydrazono)ethyl)f...)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1ccc(o1)-c1cccc(c1)C(O)=O |w:3.3|
Show InChI InChI=1S/C20H15N3O3S/c1-12(22-23-20-21-15-7-2-3-8-18(15)27-20)16-9-10-17(26-16)13-5-4-6-14(11-13)19(24)25/h2-12H,1H3,(H,24,25)
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n/an/a 1.50E+4n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436644
PNG
(CHEMBL2398276)
Show SMILES CC(N=Nc1nc2cc(Br)ccc2s1)c1ccc(o1)-c1ccc(Cl)c(c1)C(O)=O |w:3.3|
Show InChI InChI=1S/C20H13BrClN3O3S/c1-10(24-25-20-23-15-9-12(21)3-7-18(15)29-20)16-5-6-17(28-16)11-2-4-14(22)13(8-11)19(26)27/h2-10H,1H3,(H,26,27)
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n/an/a 1.50E+4n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436642
PNG
(CHEMBL2398273)
Show SMILES CC(N=Nc1nc2ccc(Cl)cc2s1)c1ccc(o1)-c1ccc(Cl)c(c1)C(O)=O |w:3.3|
Show InChI InChI=1S/C20H13Cl2N3O3S/c1-10(24-25-20-23-15-5-3-12(21)9-18(15)29-20)16-6-7-17(28-16)11-2-4-14(22)13(8-11)19(26)27/h2-10H,1H3,(H,26,27)
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n/an/a 1.70E+4n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436627
PNG
(CHEMBL2398290)
Show SMILES Cc1c(cccc1-c1ccc(CN=Nc2nc3ccccc3s2)o1)C(O)=O |w:13.14|
Show InChI InChI=1S/C20H15N3O3S/c1-12-14(5-4-6-15(12)19(24)25)17-10-9-13(26-17)11-21-23-20-22-16-7-2-3-8-18(16)27-20/h2-10H,11H2,1H3,(H,24,25)
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n/an/a 2.00E+4n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Displacement of biotinylated-Bim from Bcl-Xl (unknown origin) by fluorescence polarization assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 2


(Homo sapiens (Human))		BDBM50436627
PNG
(CHEMBL2398290)
Show SMILES Cc1c(cccc1-c1ccc(CN=Nc2nc3ccccc3s2)o1)C(O)=O |w:13.14|
Show InChI InChI=1S/C20H15N3O3S/c1-12-14(5-4-6-15(12)19(24)25)17-10-9-13(26-17)11-21-23-20-22-16-7-2-3-8-18(16)27-20/h2-10H,11H2,1H3,(H,24,25)
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n/an/a>3.30E+4n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to Bcl-w (unknown origin) by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436641
PNG
(CHEMBL2398295)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1ccc(o1)-c1cc(ccc1Cl)C(O)=O |w:3.3|
Show InChI InChI=1S/C20H14ClN3O3S/c1-11(23-24-20-22-15-4-2-3-5-18(15)28-20)16-8-9-17(27-16)13-10-12(19(25)26)6-7-14(13)21/h2-11H,1H3,(H,25,26)
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n/an/a 7.60E+4n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436631
PNG
(CHEMBL2398280)
Show SMILES CC(N=Nc1ccc2ccccc2n1)c1ccc(o1)-c1cccc(C(O)=O)c1Cl |w:3.3|
Show InChI InChI=1S/C22H16ClN3O3/c1-13(25-26-20-12-9-14-5-2-3-8-17(14)24-20)18-10-11-19(29-18)15-6-4-7-16(21(15)23)22(27)28/h2-13H,1H3,(H,27,28)
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n/an/a>1.00E+5n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436640
PNG
(CHEMBL2398293)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1ccc(o1)-c1ccc(cc1)C(O)=O |w:3.3|
Show InChI InChI=1S/C20H15N3O3S/c1-12(22-23-20-21-15-4-2-3-5-18(15)27-20)16-10-11-17(26-16)13-6-8-14(9-7-13)19(24)25/h2-12H,1H3,(H,24,25)
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n/an/a>1.00E+5n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436639
PNG
(CHEMBL2398298)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1ccc(o1)-c1cc(cc(c1)C(O)=O)C(O)=O |w:3.3|
Show InChI InChI=1S/C21H15N3O5S/c1-11(23-24-21-22-15-4-2-3-5-18(15)30-21)16-6-7-17(29-16)12-8-13(19(25)26)10-14(9-12)20(27)28/h2-11H,1H3,(H,25,26)(H,27,28)
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n/an/a>1.00E+5n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436635
PNG
(CHEMBL2398271)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1ccc(o1)-c1cccc(CC(O)=O)c1 |w:3.3|
Show InChI InChI=1S/C21H17N3O3S/c1-13(23-24-21-22-16-7-2-3-8-19(16)28-21)17-9-10-18(27-17)15-6-4-5-14(11-15)12-20(25)26/h2-11,13H,12H2,1H3,(H,25,26)
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n/an/a>1.00E+5n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436632
PNG
(CHEMBL2398279)
Show SMILES CC(N=Nc1nc2ccccc2n1C)c1ccc(o1)-c1ccc(Cl)c(c1)C(O)=O |w:3.3|
Show InChI InChI=1S/C21H17ClN4O3/c1-12(24-25-21-23-16-5-3-4-6-17(16)26(21)2)18-9-10-19(29-18)13-7-8-15(22)14(11-13)20(27)28/h3-12H,1-2H3,(H,27,28)
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n/an/a>1.00E+5n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436634
PNG
(CHEMBL2398275)
Show SMILES CC(N=Nc1nc2ccc(cc2s1)C(F)(F)F)c1ccc(o1)-c1ccc(Cl)c(c1)C(O)=O |w:3.3|
Show InChI InChI=1S/C21H13ClF3N3O3S/c1-10(16-6-7-17(31-16)11-2-4-14(22)13(8-11)19(29)30)27-28-20-26-15-5-3-12(21(23,24)25)9-18(15)32-20/h2-10H,1H3,(H,29,30)
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n/an/a>1.00E+5n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436630
PNG
(CHEMBL2396672)
Show SMILES OC(=O)c1cccc(c1)-c1ccc(CN=Nc2ncc(s2)-c2ccccc2)o1 |w:15.16|
Show InChI InChI=1S/C21H15N3O3S/c25-20(26)16-8-4-7-15(11-16)18-10-9-17(27-18)12-23-24-21-22-13-19(28-21)14-5-2-1-3-6-14/h1-11,13H,12H2,(H,25,26)
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n/an/a>1.00E+5n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436629
PNG
(CHEMBL2398281)
Show SMILES CC(=NNC(=O)c1ccccc1)c1ccc(o1)-c1cccc(c1)C(O)=O |w:2.2|
Show InChI InChI=1S/C20H16N2O4/c1-13(21-22-19(23)14-6-3-2-4-7-14)17-10-11-18(26-17)15-8-5-9-16(12-15)20(24)25/h2-12H,1H3,(H,22,23)(H,24,25)
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n/an/a>1.00E+5n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436638
PNG
(CHEMBL2398268)
Show SMILES [O-][N+](=O)c1cccc(c1)-c1ccc(CN=Nc2nc3ccccc3s2)o1 |w:15.16|
Show InChI InChI=1S/C18H12N4O3S/c23-22(24)13-5-3-4-12(10-13)16-9-8-14(25-16)11-19-21-18-20-15-6-1-2-7-17(15)26-18/h1-10H,11H2
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n/an/a>1.00E+5n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436637
PNG
(CHEMBL2398269)
Show SMILES COC(=O)c1cccc(c1)-c1ccc(CN=Nc2nc3ccccc3s2)o1 |w:16.17|
Show InChI InChI=1S/C20H15N3O3S/c1-25-19(24)14-6-4-5-13(11-14)17-10-9-15(26-17)12-21-23-20-22-16-7-2-3-8-18(16)27-20/h2-11H,12H2,1H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436636
PNG
(CHEMBL2398270)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1ccc(o1)-c1cccc(c1)C(N)=O |w:3.3|
Show InChI InChI=1S/C20H16N4O2S/c1-12(23-24-20-22-15-7-2-3-8-18(15)27-20)16-9-10-17(26-16)13-5-4-6-14(11-13)19(21)25/h2-12H,1H3,(H2,21,25)
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n/an/a>1.00E+5n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436633
PNG
(CHEMBL2398278)
Show SMILES CC(N=Nc1nc2ccccc2o1)c1ccc(o1)-c1cccc(C(O)=O)c1C |w:3.3|
Show InChI InChI=1S/C21H17N3O4/c1-12-14(6-5-7-15(12)20(25)26)18-11-10-17(27-18)13(2)23-24-21-22-16-8-3-4-9-19(16)28-21/h3-11,13H,1-2H3,(H,25,26)
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n/an/a>1.00E+5n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl by luminescence proximity assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))		BDBM50436627
PNG
(CHEMBL2398290)
Show SMILES Cc1c(cccc1-c1ccc(CN=Nc2nc3ccccc3s2)o1)C(O)=O |w:13.14|
Show InChI InChI=1S/C20H15N3O3S/c1-12-14(5-4-6-15(12)19(24)25)17-10-9-13(26-17)11-21-23-20-22-16-7-2-3-8-18(16)27-20/h2-10H,11H2,1H3,(H,24,25)
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n/an/a 1.67E+5n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human/mouse chimeric Mcl-1 by fluorescence polarization assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436625
PNG
(CHEMBL2398169)
Show SMILES [#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@@H]-1-[#6]-[#6]-[#6]-[#7]-1-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6]-[#6]-[#6]-[#6]-[#6@@H]-1-[#16]-[#6]-[#6@@H]-2-[#7]-[#6](=O)-[#7]-[#6@H]-1-2)-[#6@@H](-[#6])-[#6]-[#6])-[#6@@H](-[#6])-[#6]-[#6])-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6](-[#8])=O)-[#6](=O)-[#7]-[#6@@H](-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6@@H](-[#6])-[#8])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](-[#8])=O |r|
Show InChI InChI=1S/C149H242N48O46S/c1-14-72(8)112(136(235)170-68-105(204)173-98(67-111(215)216)132(231)178-87(46-51-107(207)208)123(222)187-94(63-78-29-18-17-19-30-78)130(229)188-96(65-103(151)202)131(230)179-88(47-52-108(209)210)127(226)194-116(77(13)199)140(239)189-95(64-79-40-42-80(200)43-41-79)134(233)195-115(76(12)198)139(238)182-82(32-23-55-165-144(154)155)120(219)184-91(142(241)242)36-27-59-169-148(162)163)191-124(223)83(33-24-56-166-145(156)157)175-119(218)81(31-22-54-164-143(152)153)176-128(227)92(61-70(4)5)185-122(221)86(45-50-106(205)206)177-121(220)85(44-49-102(150)201)174-118(217)75(11)171-137(236)113(73(9)15-2)192-125(224)84(34-25-57-167-146(158)159)181-138(237)114(74(10)16-3)193-126(225)89(48-53-109(211)212)180-135(234)100-37-28-60-197(100)141(240)90(35-26-58-168-147(160)161)183-129(228)93(62-71(6)7)186-133(232)97(66-110(213)214)172-104(203)39-21-20-38-101-117-99(69-244-101)190-149(243)196-117/h17-19,29-30,40-43,70-77,81-101,112-117,198-200H,14-16,20-28,31-39,44-69H2,1-13H3,(H2,150,201)(H2,151,202)(H,170,235)(H,171,236)(H,172,203)(H,173,204)(H,174,217)(H,175,218)(H,176,227)(H,177,220)(H,178,231)(H,179,230)(H,180,234)(H,181,237)(H,182,238)(H,183,228)(H,184,219)(H,185,221)(H,186,232)(H,187,222)(H,188,229)(H,189,239)(H,191,223)(H,192,224)(H,193,225)(H,194,226)(H,195,233)(H,205,206)(H,207,208)(H,209,210)(H,211,212)(H,213,214)(H,215,216)(H,241,242)(H4,152,153,164)(H4,154,155,165)(H4,156,157,166)(H4,158,159,167)(H4,160,161,168)(H4,162,163,169)(H2,190,196,243)/t72-,73-,74-,75-,76+,77+,81-,82-,83-,84-,85-,86-,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,112-,113-,114-,115-,116-,117-/m0/s1
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n/an/an/a 0.140n/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl assessed as dissociation rate by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50181876
PNG
(CHEMBL371861 | N-(4'-fluoro-biphenyl-4-carbonyl)-3...)
Show SMILES [O-][N+](=O)c1cc(ccc1NCCSc1ccccc1)S(=O)(=O)NC(=O)c1ccc(cc1)-c1ccc(F)cc1
Show InChI InChI=1S/C27H22FN3O5S2/c28-22-12-10-20(11-13-22)19-6-8-21(9-7-19)27(32)30-38(35,36)24-14-15-25(26(18-24)31(33)34)29-16-17-37-23-4-2-1-3-5-23/h1-15,18,29H,16-17H2,(H,30,32)
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n/an/an/a 900n/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl assessed as direct binding constant at steady state by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436643
PNG
(3-(5-(1-(2-(Benzo[d]thiazol-2-yl)hydrazono)ethyl)f...)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1ccc(o1)-c1cccc(c1)C(O)=O |w:3.3|
Show InChI InChI=1S/C20H15N3O3S/c1-12(22-23-20-21-15-7-2-3-8-18(15)27-20)16-9-10-17(26-16)13-5-4-6-14(11-13)19(24)25/h2-12H,1H3,(H,24,25)
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n/an/an/a 1.20E+4n/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl assessed as dissociation rate by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436643
PNG
(3-(5-(1-(2-(Benzo[d]thiazol-2-yl)hydrazono)ethyl)f...)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1ccc(o1)-c1cccc(c1)C(O)=O |w:3.3|
Show InChI InChI=1S/C20H15N3O3S/c1-12(22-23-20-21-15-7-2-3-8-18(15)27-20)16-9-10-17(26-16)13-5-4-6-14(11-13)19(24)25/h2-12H,1H3,(H,24,25)
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n/an/an/a 9.00E+3n/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl assessed as direct binding constant at steady state by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM21447
PNG
(4-(4-{[2-(4-chlorophenyl)phenyl]methyl}piperazin-1...)
Show SMILES CN(C)CC[C@H](CSc1ccccc1)Nc1ccc(cc1[N+]([O-])=O)S(=O)(=O)NC(=O)c1ccc(cc1)N1CCN(Cc2ccccc2-c2ccc(Cl)cc2)CC1 |r|
Show InChI InChI=1S/C42H45ClN6O5S2/c1-46(2)23-22-35(30-55-37-9-4-3-5-10-37)44-40-21-20-38(28-41(40)49(51)52)56(53,54)45-42(50)32-14-18-36(19-15-32)48-26-24-47(25-27-48)29-33-8-6-7-11-39(33)31-12-16-34(43)17-13-31/h3-21,28,35,44H,22-27,29-30H2,1-2H3,(H,45,50)/t35-/m1/s1
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n/an/an/a 0.130n/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl assessed as dissociation rate by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM109232
PNG
(6-(8-(2-(Benzothiazol-2-yl)hydrazono)-5,6,7,8-tetr...)
Show SMILES OC(=O)c1cccc(n1)-c1ccc2CCCC(=NNc3nc4ccccc4s3)c2c1 |w:17.18|
Show InChI InChI=1S/C23H18N4O2S/c28-22(29)20-9-4-7-17(24-20)15-12-11-14-5-3-8-18(16(14)13-15)26-27-23-25-19-6-1-2-10-21(19)30-23/h1-2,4,6-7,9-13H,3,5,8H2,(H,25,27)(H,28,29)
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n/an/an/a 4.10n/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl assessed as dissociation rate by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436648
PNG
(CHEMBL2398286)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1cccc(c1)-c1cccc(n1)C(O)=O |w:3.3|
Show InChI InChI=1S/C21H16N4O2S/c1-13(24-25-21-23-17-8-2-3-11-19(17)28-21)14-6-4-7-15(12-14)16-9-5-10-18(22-16)20(26)27/h2-13H,1H3,(H,26,27)
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n/an/an/a 79n/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl assessed as dissociation rate by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50436648
PNG
(CHEMBL2398286)
Show SMILES CC(N=Nc1nc2ccccc2s1)c1cccc(c1)-c1cccc(n1)C(O)=O |w:3.3|
Show InChI InChI=1S/C21H16N4O2S/c1-13(24-25-21-23-17-8-2-3-11-19(17)28-21)14-6-4-7-15(12-14)16-9-5-10-18(22-16)20(26)27/h2-13H,1H3,(H,26,27)
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n/an/an/a 61n/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl assessed as direct binding constant at steady state by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
Bcl-2-like protein 1


(Homo sapiens (Human))		BDBM50181876
PNG
(CHEMBL371861 | N-(4'-fluoro-biphenyl-4-carbonyl)-3...)
Show SMILES [O-][N+](=O)c1cc(ccc1NCCSc1ccccc1)S(=O)(=O)NC(=O)c1ccc(cc1)-c1ccc(F)cc1
Show InChI InChI=1S/C27H22FN3O5S2/c28-22-12-10-20(11-13-22)19-6-8-21(9-7-19)27(32)30-38(35,36)24-14-15-25(26(18-24)31(33)34)29-16-17-37-23-4-2-1-3-5-23/h1-15,18,29H,16-17H2,(H,30,32)
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n/an/an/a 1.90E+3n/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Binding affinity to human GST-tagged Bcl-Xl assessed as dissociation rate by surface plasmon resonance assay

J Med Chem 56: 5514-40 (2014)


Article DOI: 10.1021/jm400556w
BindingDB Entry DOI: 10.7270/Q2X92CQT
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%