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Compile Data Set for Download or QSAR

Found 16 hits from Astellas Pharm Inc.   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Signal transducer and activator of transcription 6


(Homo sapiens)
BDBM50197554
PNG
(2-(3-chloro-4-hydroxyphenethylamino)-4-(benzylamin...)
Show SMILES NC(=O)c1cnc(NCCc2ccc(O)c(Cl)c2)nc1NCc1ccccc1
Show InChI InChI=1S/C20H20ClN5O2/c21-16-10-13(6-7-17(16)27)8-9-23-20-25-12-15(18(22)28)19(26-20)24-11-14-4-2-1-3-5-14/h1-7,10,12,27H,8-9,11H2,(H2,22,28)(H2,23,24,25,26)
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n/an/a 21n/an/an/an/an/an/a



Astellas Pharm Inc.

Curated by ChEMBL


Assay Description
Inhibition of STAT6 in human IL4-stimulated FW4 cells


Bioorg Med Chem 15: 1044-55 (2006)


Article DOI: 10.1016/j.bmc.2006.10.015
BindingDB Entry DOI: 10.7270/Q2JQ11TC
More data for this
Ligand-Target Pair
Signal transducer and activator of transcription 6


(Homo sapiens)
BDBM50370949
PNG
(CHEMBL226930)
Show SMILES CNC(=O)c1cnc(NCCc2ccc(O)c(Cl)c2)nc1NCc1ccccc1
Show InChI InChI=1S/C21H22ClN5O2/c1-23-20(29)16-13-26-21(24-10-9-14-7-8-18(28)17(22)11-14)27-19(16)25-12-15-5-3-2-4-6-15/h2-8,11,13,28H,9-10,12H2,1H3,(H,23,29)(H2,24,25,26,27)
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n/an/a 30n/an/an/an/an/an/a



Astellas Pharm Inc.

Curated by ChEMBL


Assay Description
Inhibition of STAT6 in human IL4-stimulated FW4 cells


Bioorg Med Chem 15: 1044-55 (2006)


Article DOI: 10.1016/j.bmc.2006.10.015
BindingDB Entry DOI: 10.7270/Q2JQ11TC
More data for this
Ligand-Target Pair
Signal transducer and activator of transcription 6


(Homo sapiens)
BDBM50370952
PNG
(CHEMBL228018)
Show SMILES Cc1cccc(Nc2nc(NCCc3ccc(O)c(Cl)c3)ncc2C(N)=O)c1
Show InChI InChI=1S/C20H20ClN5O2/c1-12-3-2-4-14(9-12)25-19-15(18(22)28)11-24-20(26-19)23-8-7-13-5-6-17(27)16(21)10-13/h2-6,9-11,27H,7-8H2,1H3,(H2,22,28)(H2,23,24,25,26)
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n/an/a 45n/an/an/an/an/an/a



Astellas Pharm Inc.

Curated by ChEMBL


Assay Description
Inhibition of STAT6 in human IL4-stimulated FW4 cells


Bioorg Med Chem 15: 1044-55 (2006)


Article DOI: 10.1016/j.bmc.2006.10.015
BindingDB Entry DOI: 10.7270/Q2JQ11TC
More data for this
Ligand-Target Pair
Signal transducer and activator of transcription 6


(Homo sapiens)
BDBM50370950
PNG
(CHEMBL387668)
Show SMILES Cc1cccc(Nc2nc(NCCc3ccc(O)c(F)c3)ncc2C(N)=O)c1
Show InChI InChI=1S/C20H20FN5O2/c1-12-3-2-4-14(9-12)25-19-15(18(22)28)11-24-20(26-19)23-8-7-13-5-6-17(27)16(21)10-13/h2-6,9-11,27H,7-8H2,1H3,(H2,22,28)(H2,23,24,25,26)
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n/an/a 64n/an/an/an/an/an/a



Astellas Pharm Inc.

Curated by ChEMBL


Assay Description
Inhibition of STAT6 in human IL4-stimulated FW4 cells


Bioorg Med Chem 15: 1044-55 (2006)


Article DOI: 10.1016/j.bmc.2006.10.015
BindingDB Entry DOI: 10.7270/Q2JQ11TC
More data for this
Ligand-Target Pair
Signal transducer and activator of transcription 6


(Homo sapiens)
BDBM50370956
PNG
(CHEMBL389647)
Show SMILES Cc1cccc(Nc2nc(NCCc3ccc(O)c(Br)c3)ncc2C(N)=O)c1
Show InChI InChI=1S/C20H20BrN5O2/c1-12-3-2-4-14(9-12)25-19-15(18(22)28)11-24-20(26-19)23-8-7-13-5-6-17(27)16(21)10-13/h2-6,9-11,27H,7-8H2,1H3,(H2,22,28)(H2,23,24,25,26)
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n/an/a 83n/an/an/an/an/an/a



Astellas Pharm Inc.

Curated by ChEMBL


Assay Description
Inhibition of STAT6 in human IL4-stimulated FW4 cells


Bioorg Med Chem 15: 1044-55 (2006)


Article DOI: 10.1016/j.bmc.2006.10.015
BindingDB Entry DOI: 10.7270/Q2JQ11TC
More data for this
Ligand-Target Pair
Signal transducer and activator of transcription 6


(Homo sapiens)
BDBM50197567
PNG
(2-(4-hydroxyphenethylamino)-4-(benzylamino)pyrimid...)
Show SMILES NC(=O)c1cnc(NCCc2ccc(O)cc2)nc1NCc1ccccc1
Show InChI InChI=1S/C20H21N5O2/c21-18(27)17-13-24-20(22-11-10-14-6-8-16(26)9-7-14)25-19(17)23-12-15-4-2-1-3-5-15/h1-9,13,26H,10-12H2,(H2,21,27)(H2,22,23,24,25)
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n/an/a 88n/an/an/an/an/an/a



Astellas Pharm Inc.

Curated by ChEMBL


Assay Description
Inhibition of STAT6 in human IL4-stimulated FW4 cells


Bioorg Med Chem 15: 1044-55 (2006)


Article DOI: 10.1016/j.bmc.2006.10.015
BindingDB Entry DOI: 10.7270/Q2JQ11TC
More data for this
Ligand-Target Pair
Signal transducer and activator of transcription 6


(Homo sapiens)
BDBM50370951
PNG
(CHEMBL427436)
Show SMILES NC(=O)c1cnc(NCCc2ccc(O)cc2)nc1NC1CCCCC1
Show InChI InChI=1S/C19H25N5O2/c20-17(26)16-12-22-19(21-11-10-13-6-8-15(25)9-7-13)24-18(16)23-14-4-2-1-3-5-14/h6-9,12,14,25H,1-5,10-11H2,(H2,20,26)(H2,21,22,23,24)
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n/an/a 100n/an/an/an/an/an/a



Astellas Pharm Inc.

Curated by ChEMBL


Assay Description
Inhibition of STAT6 in human IL4-stimulated FW4 cells


Bioorg Med Chem 15: 1044-55 (2006)


Article DOI: 10.1016/j.bmc.2006.10.015
BindingDB Entry DOI: 10.7270/Q2JQ11TC
More data for this
Ligand-Target Pair
Signal transducer and activator of transcription 6


(Homo sapiens)
BDBM50370959
PNG
(CHEMBL226770)
Show SMILES Cc1cccc(Nc2nc(NCCc3ccc(O)c(C)c3)ncc2C(N)=O)c1
Show InChI InChI=1S/C21H23N5O2/c1-13-4-3-5-16(10-13)25-20-17(19(22)28)12-24-21(26-20)23-9-8-15-6-7-18(27)14(2)11-15/h3-7,10-12,27H,8-9H2,1-2H3,(H2,22,28)(H2,23,24,25,26)
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n/an/a 130n/an/an/an/an/an/a



Astellas Pharm Inc.

Curated by ChEMBL


Assay Description
Inhibition of STAT6 in human IL4-stimulated FW4 cells


Bioorg Med Chem 15: 1044-55 (2006)


Article DOI: 10.1016/j.bmc.2006.10.015
BindingDB Entry DOI: 10.7270/Q2JQ11TC
More data for this
Ligand-Target Pair
Signal transducer and activator of transcription 6


(Homo sapiens)
BDBM50370958
PNG
(CHEMBL227748)
Show SMILES CNC(=O)c1cnc(NCCc2ccc(O)cc2)nc1Nc1cccc(C)c1
Show InChI InChI=1S/C21H23N5O2/c1-14-4-3-5-16(12-14)25-19-18(20(28)22-2)13-24-21(26-19)23-11-10-15-6-8-17(27)9-7-15/h3-9,12-13,27H,10-11H2,1-2H3,(H,22,28)(H2,23,24,25,26)
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n/an/a 170n/an/an/an/an/an/a



Astellas Pharm Inc.

Curated by ChEMBL


Assay Description
Inhibition of STAT6 in human IL4-stimulated FW4 cells


Bioorg Med Chem 15: 1044-55 (2006)


Article DOI: 10.1016/j.bmc.2006.10.015
BindingDB Entry DOI: 10.7270/Q2JQ11TC
More data for this
Ligand-Target Pair
Signal transducer and activator of transcription 6


(Homo sapiens)
BDBM50370954
PNG
(CHEMBL376085)
Show SMILES Cc1cccc(Nc2nc(NCCc3ccc(O)cc3)ncc2C(N)=O)c1
Show InChI InChI=1S/C20H21N5O2/c1-13-3-2-4-15(11-13)24-19-17(18(21)27)12-23-20(25-19)22-10-9-14-5-7-16(26)8-6-14/h2-8,11-12,26H,9-10H2,1H3,(H2,21,27)(H2,22,23,24,25)
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n/an/a 190n/an/an/an/an/an/a



Astellas Pharm Inc.

Curated by ChEMBL


Assay Description
Inhibition of STAT6 in human IL4-stimulated FW4 cells


Bioorg Med Chem 15: 1044-55 (2006)


Article DOI: 10.1016/j.bmc.2006.10.015
BindingDB Entry DOI: 10.7270/Q2JQ11TC
More data for this
Ligand-Target Pair
Signal transducer and activator of transcription 6


(Homo sapiens)
BDBM50370957
PNG
(CHEMBL389452)
Show SMILES CCNC(=O)c1cnc(NCCc2ccc(O)cc2)nc1Nc1cccc(C)c1
Show InChI InChI=1S/C22H25N5O2/c1-3-23-21(29)19-14-25-22(24-12-11-16-7-9-18(28)10-8-16)27-20(19)26-17-6-4-5-15(2)13-17/h4-10,13-14,28H,3,11-12H2,1-2H3,(H,23,29)(H2,24,25,26,27)
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n/an/a 380n/an/an/an/an/an/a



Astellas Pharm Inc.

Curated by ChEMBL


Assay Description
Inhibition of STAT6 in human IL4-stimulated FW4 cells


Bioorg Med Chem 15: 1044-55 (2006)


Article DOI: 10.1016/j.bmc.2006.10.015
BindingDB Entry DOI: 10.7270/Q2JQ11TC
More data for this
Ligand-Target Pair
Signal transducer and activator of transcription 6


(Homo sapiens)
BDBM50370948
PNG
(CHEMBL227804)
Show SMILES NC(=O)c1cnc(NCCc2ccc(O)cc2)nc1Nc1ccccc1
Show InChI InChI=1S/C19H19N5O2/c20-17(26)16-12-22-19(21-11-10-13-6-8-15(25)9-7-13)24-18(16)23-14-4-2-1-3-5-14/h1-9,12,25H,10-11H2,(H2,20,26)(H2,21,22,23,24)
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n/an/a 410n/an/an/an/an/an/a



Astellas Pharm Inc.

Curated by ChEMBL


Assay Description
Inhibition of STAT6 in human IL4-stimulated FW4 cells


Bioorg Med Chem 15: 1044-55 (2006)


Article DOI: 10.1016/j.bmc.2006.10.015
BindingDB Entry DOI: 10.7270/Q2JQ11TC
More data for this
Ligand-Target Pair
Signal transducer and activator of transcription 6


(Homo sapiens)
BDBM50370953
PNG
(CHEMBL388357)
Show SMILES COc1cc(CCNc2ncc(C(N)=O)c(Nc3cccc(C)c3)n2)ccc1O
Show InChI InChI=1S/C21H23N5O3/c1-13-4-3-5-15(10-13)25-20-16(19(22)28)12-24-21(26-20)23-9-8-14-6-7-17(27)18(11-14)29-2/h3-7,10-12,27H,8-9H2,1-2H3,(H2,22,28)(H2,23,24,25,26)
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n/an/a 660n/an/an/an/an/an/a



Astellas Pharm Inc.

Curated by ChEMBL


Assay Description
Inhibition of STAT6 in human IL4-stimulated FW4 cells


Bioorg Med Chem 15: 1044-55 (2006)


Article DOI: 10.1016/j.bmc.2006.10.015
BindingDB Entry DOI: 10.7270/Q2JQ11TC
More data for this
Ligand-Target Pair
Signal transducer and activator of transcription 6


(Homo sapiens)
BDBM50370946
PNG
(CHEMBL374977)
Show SMILES CC(C)NC(=O)c1cnc(NCCc2ccc(O)cc2)nc1Nc1cccc(C)c1
Show InChI InChI=1S/C23H27N5O2/c1-15(2)26-22(30)20-14-25-23(24-12-11-17-7-9-19(29)10-8-17)28-21(20)27-18-6-4-5-16(3)13-18/h4-10,13-15,29H,11-12H2,1-3H3,(H,26,30)(H2,24,25,27,28)
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n/an/a 1.10E+3n/an/an/an/an/an/a



Astellas Pharm Inc.

Curated by ChEMBL


Assay Description
Inhibition of STAT6 in human IL4-stimulated FW4 cells


Bioorg Med Chem 15: 1044-55 (2006)


Article DOI: 10.1016/j.bmc.2006.10.015
BindingDB Entry DOI: 10.7270/Q2JQ11TC
More data for this
Ligand-Target Pair
Signal transducer and activator of transcription 6


(Homo sapiens)
BDBM50370955
PNG
(CHEMBL226928)
Show SMILES Cc1cccc(Nc2nc(NCCc3cccc(O)c3)ncc2C(N)=O)c1
Show InChI InChI=1S/C20H21N5O2/c1-13-4-2-6-15(10-13)24-19-17(18(21)27)12-23-20(25-19)22-9-8-14-5-3-7-16(26)11-14/h2-7,10-12,26H,8-9H2,1H3,(H2,21,27)(H2,22,23,24,25)
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n/an/a 3.00E+3n/an/an/an/an/an/a



Astellas Pharm Inc.

Curated by ChEMBL


Assay Description
Inhibition of STAT6 in human IL4-stimulated FW4 cells


Bioorg Med Chem 15: 1044-55 (2006)


Article DOI: 10.1016/j.bmc.2006.10.015
BindingDB Entry DOI: 10.7270/Q2JQ11TC
More data for this
Ligand-Target Pair
Signal transducer and activator of transcription 6


(Homo sapiens)
BDBM50370947
PNG
(CHEMBL227803)
Show SMILES CN(C)C(=O)c1cnc(NCCc2ccc(O)cc2)nc1Nc1cccc(C)c1
Show InChI InChI=1S/C22H25N5O2/c1-15-5-4-6-17(13-15)25-20-19(21(29)27(2)3)14-24-22(26-20)23-12-11-16-7-9-18(28)10-8-16/h4-10,13-14,28H,11-12H2,1-3H3,(H2,23,24,25,26)
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n/an/a 8.20E+3n/an/an/an/an/an/a



Astellas Pharm Inc.

Curated by ChEMBL


Assay Description
Inhibition of STAT6 in human IL4-stimulated FW4 cells


Bioorg Med Chem 15: 1044-55 (2006)


Article DOI: 10.1016/j.bmc.2006.10.015
BindingDB Entry DOI: 10.7270/Q2JQ11TC
More data for this
Ligand-Target Pair