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Compile Data Set for Download or QSAR

Found 30 hits with Last Name = 'aikawa' and Initial = 'y'   
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
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50180049
PNG
(3-[2-isobutoxy-5-(4-isobutoxybenzoyl)phenyl]propio...)
Show SMILES CC(C)COc1ccc(cc1)C(=O)c1ccc(OCC(C)C)c(CCC(O)=O)c1
Show InChI InChI=1S/C24H30O5/c1-16(2)14-28-21-9-5-18(6-10-21)24(27)20-7-11-22(29-15-17(3)4)19(13-20)8-12-23(25)26/h5-7,9-11,13,16-17H,8,12,14-15H2,1-4H3,(H,25,26)
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n/an/a 5.00E+3n/an/an/an/an/an/a



Toyama Chemical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibition of the expression of AP1-luciferase by TPA-stimulated NIH3T3 cells


J Med Chem 49: 80-91 (2006)


Article DOI: 10.1021/jm050550d
BindingDB Entry DOI: 10.7270/Q2VX0G2C
More data for this
Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50180047
PNG
(3-[2-isobutoxy-5-(3-isobutoxybenzoyl)phenyl]propio...)
Show SMILES CC(C)COc1cccc(c1)C(=O)c1ccc(OCC(C)C)c(CCC(O)=O)c1
Show InChI InChI=1S/C24H30O5/c1-16(2)14-28-21-7-5-6-19(13-21)24(27)20-8-10-22(29-15-17(3)4)18(12-20)9-11-23(25)26/h5-8,10,12-13,16-17H,9,11,14-15H2,1-4H3,(H,25,26)
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n/an/a 5.80E+3n/an/an/an/an/an/a



Toyama Chemical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibition of the expression of AP1-luciferase by TPA-stimulated NIH3T3 cells


J Med Chem 49: 80-91 (2006)


Article DOI: 10.1021/jm050550d
BindingDB Entry DOI: 10.7270/Q2VX0G2C
More data for this
Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50151079
PNG
((S)-3-{(S)-2-[(S)-2-((S)-2-{(S)-2-[(S)-2-(2-Amino-...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)CN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(=O)NCC(O)=O
Show InChI InChI=1S/C32H53N9O14/c1-14(2)8-18(30(53)36-16(5)27(50)38-20(10-24(44)45)28(51)35-13-26(48)49)40-32(55)21(11-25(46)47)41-31(54)19(9-15(3)4)39-29(52)17(6-7-22(34)42)37-23(43)12-33/h14-21H,6-13,33H2,1-5H3,(H2,34,42)(H,35,51)(H,36,53)(H,37,43)(H,38,50)(H,39,52)(H,40,55)(H,41,54)(H,44,45)(H,46,47)(H,48,49)/t16-,17-,18-,19-,20-,21-/m0/s1
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n/an/a 8.00E+3n/an/an/an/an/an/a



Toyama Chemical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against transcription activator protein-1 (AP-1)


J Med Chem 47: 4239-46 (2004)


Article DOI: 10.1021/jm049890+
BindingDB Entry DOI: 10.7270/Q2RX9BJG
More data for this
Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50180051
PNG
((R)-4-(4-methylpentanoyl)-8-(4-methylpentylidene)-...)
Show SMILES CC(C)CCC=C1CCC2(CC1)SC[C@H](N2C(=O)CCC(C)C)C(O)=O
Show InChI InChI=1S/C21H35NO3S/c1-15(2)6-5-7-17-10-12-21(13-11-17)22(18(14-26-21)20(24)25)19(23)9-8-16(3)4/h7,15-16,18H,5-6,8-14H2,1-4H3,(H,24,25)/b17-7-/t18-,21?/m0/s1
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n/an/a 1.18E+4n/an/an/an/an/an/a



Toyama Chemical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibition of the expression of AP1-luciferase by TPA-stimulated NIH3T3 cells


J Med Chem 49: 80-91 (2006)


Article DOI: 10.1021/jm050550d
BindingDB Entry DOI: 10.7270/Q2VX0G2C
More data for this
Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50180048
PNG
((R)-8-(3-methylbutylidene)-4-(5-methylhexanoyl)-1-...)
Show SMILES CC(C)CCCC(=O)N1[C@@H](CSC11CCC(CC1)=CCC(C)C)C(O)=O
Show InChI InChI=1S/C21H35NO3S/c1-15(2)6-5-7-19(23)22-18(20(24)25)14-26-21(22)12-10-17(11-13-21)9-8-16(3)4/h9,15-16,18H,5-8,10-14H2,1-4H3,(H,24,25)/b17-9-/t18-,21?/m0/s1
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n/an/a 1.33E+4n/an/an/an/an/an/a



Toyama Chemical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibition of the expression of AP1-luciferase by TPA-stimulated NIH3T3 cells


J Med Chem 49: 80-91 (2006)


Article DOI: 10.1021/jm050550d
BindingDB Entry DOI: 10.7270/Q2VX0G2C
More data for this
Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50151090
PNG
((S)-3-{(S)-2-[(S)-2-(2-Amino-acetylamino)-4-carbam...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)CN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(O)=O
Show InChI InChI=1S/C32H54N10O13/c1-14(2)8-18(30(53)37-16(5)27(50)39-20(10-23(35)44)28(51)36-13-26(48)49)41-32(55)21(11-25(46)47)42-31(54)19(9-15(3)4)40-29(52)17(6-7-22(34)43)38-24(45)12-33/h14-21H,6-13,33H2,1-5H3,(H2,34,43)(H2,35,44)(H,36,51)(H,37,53)(H,38,45)(H,39,50)(H,40,52)(H,41,55)(H,42,54)(H,46,47)(H,48,49)/t16-,17-,18-,19-,20-,21-/m0/s1
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n/an/a 5.20E+4n/an/an/an/an/an/a



Toyama Chemical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against transcription activator protein-1 (AP-1)


J Med Chem 47: 4239-46 (2004)


Article DOI: 10.1021/jm049890+
BindingDB Entry DOI: 10.7270/Q2RX9BJG
More data for this
Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50151088
PNG
((S)-3-{(S)-2-[(S)-2-((S)-2-{(S)-2-[(S)-2-(2-Amino-...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CN)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(=O)NCC(O)=O
Show InChI InChI=1S/C35H57N9O14/c1-17(2)11-21(42-32(55)20(9-10-25(37)45)40-26(46)15-36)34(57)44-24(14-28(49)50)35(58)43-22(12-19-7-5-4-6-8-19)33(56)39-18(3)30(53)41-23(13-27(47)48)31(54)38-16-29(51)52/h17-24H,4-16,36H2,1-3H3,(H2,37,45)(H,38,54)(H,39,56)(H,40,46)(H,41,53)(H,42,55)(H,43,58)(H,44,57)(H,47,48)(H,49,50)(H,51,52)/t18-,20-,21-,22-,23-,24-/m0/s1
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Toyama Chemical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against transcription activator protein-1 (AP-1)


J Med Chem 47: 4239-46 (2004)


Article DOI: 10.1021/jm049890+
BindingDB Entry DOI: 10.7270/Q2RX9BJG
More data for this
Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50151091
PNG
((S)-3-{(S)-2-[(S)-2-(2-Amino-acetylamino)-4-carbam...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)CN)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)NCC(O)=O
Show InChI InChI=1S/C31H53N9O12/c1-14(2)9-19(29(50)36-17(6)27(48)35-16(5)26(47)34-13-25(45)46)39-31(52)21(11-24(43)44)40-30(51)20(10-15(3)4)38-28(49)18(7-8-22(33)41)37-23(42)12-32/h14-21H,7-13,32H2,1-6H3,(H2,33,41)(H,34,47)(H,35,48)(H,36,50)(H,37,42)(H,38,49)(H,39,52)(H,40,51)(H,43,44)(H,45,46)/t16-,17-,18-,19-,20-,21-/m0/s1
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Toyama Chemical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against transcription activator protein-1 (AP-1)


J Med Chem 47: 4239-46 (2004)


Article DOI: 10.1021/jm049890+
BindingDB Entry DOI: 10.7270/Q2RX9BJG
More data for this
Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50151089
PNG
((S)-3-{(S)-2-[(S)-2-((S)-2-{(S)-2-[(S)-2-(2-Amino-...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H](CCC(N)=O)NC(=O)CN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(=O)NCC(O)=O
Show InChI InChI=1S/C35H57N9O14/c1-17(2)11-21(33(56)39-18(3)30(53)41-23(13-27(47)48)31(54)38-16-29(51)52)42-35(58)24(14-28(49)50)44-34(57)22(12-19-7-5-4-6-8-19)43-32(55)20(9-10-25(37)45)40-26(46)15-36/h17-24H,4-16,36H2,1-3H3,(H2,37,45)(H,38,54)(H,39,56)(H,40,46)(H,41,53)(H,42,58)(H,43,55)(H,44,57)(H,47,48)(H,49,50)(H,51,52)/t18-,20-,21-,22-,23-,24-/m0/s1
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Toyama Chemical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against transcription activator protein-1 (AP-1)


J Med Chem 47: 4239-46 (2004)


Article DOI: 10.1021/jm049890+
BindingDB Entry DOI: 10.7270/Q2RX9BJG
More data for this
Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50151095
PNG
((S)-3-{(S)-2-[(S)-2-((S)-2-{(S)-2-[(S)-2-(2-Amino-...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)CN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(=O)NCC(O)=O
Show InChI InChI=1S/C31H51N9O14/c1-13(2)6-16(28(51)35-15(5)26(49)37-19(9-23(43)44)27(50)34-12-25(47)48)38-31(54)20(10-24(45)46)40-29(52)17(7-14(3)4)39-30(53)18(8-21(33)41)36-22(42)11-32/h13-20H,6-12,32H2,1-5H3,(H2,33,41)(H,34,50)(H,35,51)(H,36,42)(H,37,49)(H,38,54)(H,39,53)(H,40,52)(H,43,44)(H,45,46)(H,47,48)/t15-,16-,17-,18-,19-,20-/m0/s1
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Toyama Chemical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against transcription activator protein-1 (AP-1)


J Med Chem 47: 4239-46 (2004)


Article DOI: 10.1021/jm049890+
BindingDB Entry DOI: 10.7270/Q2RX9BJG
More data for this
Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50151087
PNG
((S)-2-{(S)-2-[(S)-2-((S)-2-{(S)-2-[(S)-2-(2-Amino-...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)CN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(O)=O
Show InChI InChI=1S/C30H50N8O13/c1-13(2)8-17(27(47)33-15(5)25(45)38-20(30(50)51)11-24(43)44)36-29(49)19(10-23(41)42)37-28(48)18(9-14(3)4)35-26(46)16(6-7-21(32)39)34-22(40)12-31/h13-20H,6-12,31H2,1-5H3,(H2,32,39)(H,33,47)(H,34,40)(H,35,46)(H,36,49)(H,37,48)(H,38,45)(H,41,42)(H,43,44)(H,50,51)/t15-,16-,17-,18-,19-,20-/m0/s1
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Toyama Chemical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against transcription activator protein-1 (AP-1)


J Med Chem 47: 4239-46 (2004)


Article DOI: 10.1021/jm049890+
BindingDB Entry DOI: 10.7270/Q2RX9BJG
More data for this
Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50151086
PNG
((S)-3-{(S)-2-[(S)-2-((S)-2-{(S)-2-[(S)-2-(2-Amino-...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)CN)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(=O)NCC(O)=O
Show InChI InChI=1S/C29H47N9O14/c1-12(2)7-16(37-27(50)15(5-6-19(31)39)35-20(40)10-30)29(52)38-18(9-22(43)44)28(51)34-13(3)24(47)33-14(4)25(48)36-17(8-21(41)42)26(49)32-11-23(45)46/h12-18H,5-11,30H2,1-4H3,(H2,31,39)(H,32,49)(H,33,47)(H,34,51)(H,35,40)(H,36,48)(H,37,50)(H,38,52)(H,41,42)(H,43,44)(H,45,46)/t13-,14-,15-,16-,17-,18-/m0/s1
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Toyama Chemical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against transcription activator protein-1 (AP-1)


J Med Chem 47: 4239-46 (2004)


Article DOI: 10.1021/jm049890+
BindingDB Entry DOI: 10.7270/Q2RX9BJG
More data for this
Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50151085
PNG
((S)-3-[(S)-2-((S)-2-{(S)-2-[(S)-2-((S)-2-Amino-4-c...)
Show SMILES CC(C)C[C@H](NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(=O)NCC(O)=O
Show InChI InChI=1S/C30H50N8O13/c1-13(2)8-17(28(49)34-15(5)25(46)35-19(10-22(40)41)27(48)33-12-24(44)45)37-30(51)20(11-23(42)43)38-29(50)18(9-14(3)4)36-26(47)16(31)6-7-21(32)39/h13-20H,6-12,31H2,1-5H3,(H2,32,39)(H,33,48)(H,34,49)(H,35,46)(H,36,47)(H,37,51)(H,38,50)(H,40,41)(H,42,43)(H,44,45)/t15-,16-,17-,18-,19-,20-/m0/s1
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Toyama Chemical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against transcription activator protein-1 (AP-1)


J Med Chem 47: 4239-46 (2004)


Article DOI: 10.1021/jm049890+
BindingDB Entry DOI: 10.7270/Q2RX9BJG
More data for this
Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50151084
PNG
((S)-3-{(S)-2-[(S)-2-((S)-2-{(S)-2-[(S)-2-(2-Amino-...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)CN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](C)C(O)=O
Show InChI InChI=1S/C33H55N9O14/c1-14(2)9-19(29(51)36-16(5)27(49)39-21(11-25(45)46)30(52)37-17(6)33(55)56)41-32(54)22(12-26(47)48)42-31(53)20(10-15(3)4)40-28(50)18(7-8-23(35)43)38-24(44)13-34/h14-22H,7-13,34H2,1-6H3,(H2,35,43)(H,36,51)(H,37,52)(H,38,44)(H,39,49)(H,40,50)(H,41,54)(H,42,53)(H,45,46)(H,47,48)(H,55,56)/t16-,17-,18-,19-,20-,21-,22-/m0/s1
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Toyama Chemical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against transcription activator protein-1 (AP-1)


J Med Chem 47: 4239-46 (2004)


Article DOI: 10.1021/jm049890+
BindingDB Entry DOI: 10.7270/Q2RX9BJG
More data for this
Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50151083
PNG
((S)-3-{(S)-2-[(S)-2-((S)-2-{(S)-2-[(S)-2-(2-Amino-...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)CN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(=O)NCC(O)=O
Show InChI InChI=1S/C29H47N9O14/c1-12(2)7-16(28(51)34-14(4)24(47)36-17(8-21(41)42)26(49)32-11-23(45)46)38-29(52)18(9-22(43)44)37-25(48)13(3)33-27(50)15(5-6-19(31)39)35-20(40)10-30/h12-18H,5-11,30H2,1-4H3,(H2,31,39)(H,32,49)(H,33,50)(H,34,51)(H,35,40)(H,36,47)(H,37,48)(H,38,52)(H,41,42)(H,43,44)(H,45,46)/t13-,14-,15-,16-,17-,18-/m0/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



Toyama Chemical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against transcription activator protein-1 (AP-1)


J Med Chem 47: 4239-46 (2004)


Article DOI: 10.1021/jm049890+
BindingDB Entry DOI: 10.7270/Q2RX9BJG
More data for this
Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50151081
PNG
((S)-3-{(S)-2-[(S)-2-((S)-2-{(S)-2-[(S)-2-(2-Amino-...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)CN)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(=O)NCC(O)=O
Show InChI InChI=1S/C30H50N8O13/c1-13(2)7-17(28(49)34-16(6)26(47)36-19(9-22(40)41)27(48)32-12-24(44)45)37-30(51)20(10-23(42)43)38-29(50)18(8-14(3)4)35-25(46)15(5)33-21(39)11-31/h13-20H,7-12,31H2,1-6H3,(H,32,48)(H,33,39)(H,34,49)(H,35,46)(H,36,47)(H,37,51)(H,38,50)(H,40,41)(H,42,43)(H,44,45)/t15-,16-,17-,18-,19-,20-/m0/s1
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Toyama Chemical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against transcription activator protein-1 (AP-1)


J Med Chem 47: 4239-46 (2004)


Article DOI: 10.1021/jm049890+
BindingDB Entry DOI: 10.7270/Q2RX9BJG
More data for this
Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50151080
PNG
((S)-3-{(S)-2-[(S)-2-((S)-2-{(S)-2-[(S)-2-((S)-2-Am...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(=O)NCC(O)=O
Show InChI InChI=1S/C33H55N9O14/c1-14(2)9-19(31(54)37-17(6)28(51)39-21(11-24(44)45)29(52)36-13-26(48)49)41-33(56)22(12-25(46)47)42-32(55)20(10-15(3)4)40-30(53)18(7-8-23(35)43)38-27(50)16(5)34/h14-22H,7-13,34H2,1-6H3,(H2,35,43)(H,36,52)(H,37,54)(H,38,50)(H,39,51)(H,40,53)(H,41,56)(H,42,55)(H,44,45)(H,46,47)(H,48,49)/t16-,17-,18-,19-,20-,21-,22-/m0/s1
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Toyama Chemical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against transcription activator protein-1 (AP-1)


J Med Chem 47: 4239-46 (2004)


Article DOI: 10.1021/jm049890+
BindingDB Entry DOI: 10.7270/Q2RX9BJG
More data for this
Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50151082
PNG
((S)-3-{(S)-2-[(S)-2-((S)-2-{(S)-2-[(S)-6-Amino-2-(...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)CN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(=O)NCC(O)=O
Show InChI InChI=1S/C33H57N9O13/c1-16(2)10-20(31(53)37-18(5)28(50)39-22(12-25(44)45)29(51)36-15-27(48)49)41-33(55)23(13-26(46)47)42-32(54)21(11-17(3)4)40-30(52)19(8-6-7-9-34)38-24(43)14-35/h16-23H,6-15,34-35H2,1-5H3,(H,36,51)(H,37,53)(H,38,43)(H,39,50)(H,40,52)(H,41,55)(H,42,54)(H,44,45)(H,46,47)(H,48,49)/t18-,19-,20-,21-,22-,23-/m0/s1
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Toyama Chemical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against transcription activator protein-1 (AP-1)


J Med Chem 47: 4239-46 (2004)


Article DOI: 10.1021/jm049890+
BindingDB Entry DOI: 10.7270/Q2RX9BJG
More data for this
Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50151094
PNG
((S)-3-{2-[(S)-2-((S)-2-{(S)-2-[(S)-2-(2-Amino-acet...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)CN)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)NCC(O)=O
Show InChI InChI=1S/C31H51N9O14/c1-14(2)7-17(27(50)34-12-23(43)37-19(9-24(44)45)28(51)35-13-26(48)49)38-31(54)20(10-25(46)47)40-30(53)18(8-15(3)4)39-29(52)16(5-6-21(33)41)36-22(42)11-32/h14-20H,5-13,32H2,1-4H3,(H2,33,41)(H,34,50)(H,35,51)(H,36,42)(H,37,43)(H,38,54)(H,39,52)(H,40,53)(H,44,45)(H,46,47)(H,48,49)/t16-,17-,18-,19-,20-/m0/s1
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Toyama Chemical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against transcription activator protein-1 (AP-1)


J Med Chem 47: 4239-46 (2004)


Article DOI: 10.1021/jm049890+
BindingDB Entry DOI: 10.7270/Q2RX9BJG
More data for this
Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50151093
PNG
((S)-4-(2-Amino-acetylamino)-4-{(S)-1-[(S)-2-carbox...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(O)=O)NC(=O)CN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(=O)NCC(O)=O
Show InChI InChI=1S/C32H52N8O15/c1-14(2)8-18(30(53)35-16(5)27(50)37-20(10-24(44)45)28(51)34-13-26(48)49)39-32(55)21(11-25(46)47)40-31(54)19(9-15(3)4)38-29(52)17(6-7-23(42)43)36-22(41)12-33/h14-21H,6-13,33H2,1-5H3,(H,34,51)(H,35,53)(H,36,41)(H,37,50)(H,38,52)(H,39,55)(H,40,54)(H,42,43)(H,44,45)(H,46,47)(H,48,49)/t16-,17-,18-,19-,20-,21-/m0/s1
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Toyama Chemical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against transcription activator protein-1 (AP-1)


J Med Chem 47: 4239-46 (2004)


Article DOI: 10.1021/jm049890+
BindingDB Entry DOI: 10.7270/Q2RX9BJG
More data for this
Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50151092
PNG
((S)-3-{(S)-2-[(S)-2-((S)-2-{(S)-2-[(S)-2-(2-Amino-...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)CN)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(=O)NCC(O)=O
Show InChI InChI=1S/C31H53N9O12/c1-14(2)9-19(30(51)35-17(6)27(48)39-21(11-24(43)44)28(49)34-13-25(45)46)38-26(47)16(5)36-31(52)20(10-15(3)4)40-29(50)18(7-8-22(33)41)37-23(42)12-32/h14-21H,7-13,32H2,1-6H3,(H2,33,41)(H,34,49)(H,35,51)(H,36,52)(H,37,42)(H,38,47)(H,39,48)(H,40,50)(H,43,44)(H,45,46)/t16-,17-,18-,19-,20-,21-/m0/s1
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Toyama Chemical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity against transcription activator protein-1 (AP-1)


J Med Chem 47: 4239-46 (2004)


Article DOI: 10.1021/jm049890+
BindingDB Entry DOI: 10.7270/Q2RX9BJG
More data for this
Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50180050
PNG
(3-[2-benzyloxy-5-(4-isobutoxybenzoyl)phenyl]propio...)
Show SMILES CC(C)COc1ccc(cc1)C(=O)c1ccc(OCc2ccccc2)c(CCC(O)=O)c1
Show InChI InChI=1S/C27H28O5/c1-19(2)17-31-24-12-8-21(9-13-24)27(30)23-10-14-25(22(16-23)11-15-26(28)29)32-18-20-6-4-3-5-7-20/h3-10,12-14,16,19H,11,15,17-18H2,1-2H3,(H,28,29)
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n/an/a 4.20E+5n/an/an/an/an/an/a



Toyama Chemical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity on AP1 using ELISA based AP1 DNA binding


J Med Chem 49: 80-91 (2006)


Article DOI: 10.1021/jm050550d
BindingDB Entry DOI: 10.7270/Q2VX0G2C
More data for this
Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50180048
PNG
((R)-8-(3-methylbutylidene)-4-(5-methylhexanoyl)-1-...)
Show SMILES CC(C)CCCC(=O)N1[C@@H](CSC11CCC(CC1)=CCC(C)C)C(O)=O
Show InChI InChI=1S/C21H35NO3S/c1-15(2)6-5-7-19(23)22-18(20(24)25)14-26-21(22)12-10-17(11-13-21)9-8-16(3)4/h9,15-16,18H,5-8,10-14H2,1-4H3,(H,24,25)/b17-9-/t18-,21?/m0/s1
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n/an/a 4.60E+5n/an/an/an/an/an/a



Toyama Chemical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity on AP1 using ELISA based AP1 DNA binding


J Med Chem 49: 80-91 (2006)


Article DOI: 10.1021/jm050550d
BindingDB Entry DOI: 10.7270/Q2VX0G2C
More data for this
Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50180047
PNG
(3-[2-isobutoxy-5-(3-isobutoxybenzoyl)phenyl]propio...)
Show SMILES CC(C)COc1cccc(c1)C(=O)c1ccc(OCC(C)C)c(CCC(O)=O)c1
Show InChI InChI=1S/C24H30O5/c1-16(2)14-28-21-7-5-6-19(13-21)24(27)20-8-10-22(29-15-17(3)4)18(12-20)9-11-23(25)26/h5-8,10,12-13,16-17H,9,11,14-15H2,1-4H3,(H,25,26)
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n/an/a 6.00E+5n/an/an/an/an/an/a



Toyama Chemical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity on AP1 using ELISA based AP1 DNA binding


J Med Chem 49: 80-91 (2006)


Article DOI: 10.1021/jm050550d
BindingDB Entry DOI: 10.7270/Q2VX0G2C
More data for this
Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50180049
PNG
(3-[2-isobutoxy-5-(4-isobutoxybenzoyl)phenyl]propio...)
Show SMILES CC(C)COc1ccc(cc1)C(=O)c1ccc(OCC(C)C)c(CCC(O)=O)c1
Show InChI InChI=1S/C24H30O5/c1-16(2)14-28-21-9-5-18(6-10-21)24(27)20-7-11-22(29-15-17(3)4)19(13-20)8-12-23(25)26/h5-7,9-11,13,16-17H,8,12,14-15H2,1-4H3,(H,25,26)
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n/an/a 6.10E+5n/an/an/an/an/an/a



Toyama Chemical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity on AP1 using ELISA based AP1 DNA binding


J Med Chem 49: 80-91 (2006)


Article DOI: 10.1021/jm050550d
BindingDB Entry DOI: 10.7270/Q2VX0G2C
More data for this
Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50180051
PNG
((R)-4-(4-methylpentanoyl)-8-(4-methylpentylidene)-...)
Show SMILES CC(C)CCC=C1CCC2(CC1)SC[C@H](N2C(=O)CCC(C)C)C(O)=O
Show InChI InChI=1S/C21H35NO3S/c1-15(2)6-5-7-17-10-12-21(13-11-17)22(18(14-26-21)20(24)25)19(23)9-8-16(3)4/h7,15-16,18H,5-6,8-14H2,1-4H3,(H,24,25)/b17-7-/t18-,21?/m0/s1
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n/an/a 6.50E+5n/an/an/an/an/an/a



Toyama Chemical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity on AP1 using ELISA based AP1 DNA binding


J Med Chem 49: 80-91 (2006)


Article DOI: 10.1021/jm050550d
BindingDB Entry DOI: 10.7270/Q2VX0G2C
More data for this
Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50180052
PNG
(3-[5-(4-isobutoxybenzoyl)-2-propoxyphenyl]propioni...)
Show SMILES CCCOc1ccc(cc1CCC(O)=O)C(=O)c1ccc(OCC(C)C)cc1
Show InChI InChI=1S/C23H28O5/c1-4-13-27-21-11-7-19(14-18(21)8-12-22(24)25)23(26)17-5-9-20(10-6-17)28-15-16(2)3/h5-7,9-11,14,16H,4,8,12-13,15H2,1-3H3,(H,24,25)
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n/an/a 9.10E+5n/an/an/an/an/an/a



Toyama Chemical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity on AP1 using ELISA based AP1 DNA binding


J Med Chem 49: 80-91 (2006)


Article DOI: 10.1021/jm050550d
BindingDB Entry DOI: 10.7270/Q2VX0G2C
More data for this
Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50180046
PNG
(3-[2-isobutoxy-5-(4-propoxybenzoyl)phenyl]propioni...)
Show SMILES CCCOc1ccc(cc1)C(=O)c1ccc(OCC(C)C)c(CCC(O)=O)c1
Show InChI InChI=1S/C23H28O5/c1-4-13-27-20-9-5-17(6-10-20)23(26)19-7-11-21(28-15-16(2)3)18(14-19)8-12-22(24)25/h5-7,9-11,14,16H,4,8,12-13,15H2,1-3H3,(H,24,25)
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n/an/a 9.30E+5n/an/an/an/an/an/a



Toyama Chemical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity on AP1 using ELISA based AP1 DNA binding


J Med Chem 49: 80-91 (2006)


Article DOI: 10.1021/jm050550d
BindingDB Entry DOI: 10.7270/Q2VX0G2C
More data for this
Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50180053
PNG
(3-(5-benzoyl-2-isobutoxyphenyl)propionic acid | CH...)
Show SMILES CC(C)COc1ccc(cc1CCC(O)=O)C(=O)c1ccccc1
Show InChI InChI=1S/C20H22O4/c1-14(2)13-24-18-10-8-17(12-16(18)9-11-19(21)22)20(23)15-6-4-3-5-7-15/h3-8,10,12,14H,9,11,13H2,1-2H3,(H,21,22)
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n/an/a>2.00E+6n/an/an/an/an/an/a



Toyama Chemical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity on AP1 using ELISA based AP1 DNA binding


J Med Chem 49: 80-91 (2006)


Article DOI: 10.1021/jm050550d
BindingDB Entry DOI: 10.7270/Q2VX0G2C
More data for this
Ligand-Target Pair
Proto-oncogene c-JUN/protein c-fos


(Homo sapiens (Human))
BDBM50180045
PNG
(3-[3-(4-isobutoxybenzoyl)phenyl]propionic acid | C...)
Show SMILES CC(C)COc1ccc(cc1)C(=O)c1cccc(CCC(O)=O)c1
Show InChI InChI=1S/C20H22O4/c1-14(2)13-24-18-9-7-16(8-10-18)20(23)17-5-3-4-15(12-17)6-11-19(21)22/h3-5,7-10,12,14H,6,11,13H2,1-2H3,(H,21,22)
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Toyama Chemical Co., Ltd.

Curated by ChEMBL


Assay Description
Inhibitory activity on AP1 using ELISA based AP1 DNA binding


J Med Chem 49: 80-91 (2006)


Article DOI: 10.1021/jm050550d
BindingDB Entry DOI: 10.7270/Q2VX0G2C
More data for this
Ligand-Target Pair