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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Protein c-Fos/Transcription factor Jun' and Ligand = 'BDBM50180051'   
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
Protein c-Fos/Transcription factor Jun


(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 |wU:14.24,(-7.53,4.55,;-6,4.62,;-5.29,5.99,;-5.17,3.32,;-3.63,3.39,;-2.8,2.1,;-1.26,2.17,;-.42,.88,;1.12,.95,;1.82,2.31,;1,3.6,;-.54,3.53,;2.67,3.6,;4.15,3.19,;4.22,1.65,;2.78,1.11,;2.37,-.38,;.88,-.77,;3.45,-1.47,;3.05,-2.96,;4.13,-4.05,;3.72,-5.54,;5.62,-3.66,;5.51,.8,;6.88,1.49,;5.42,-.73,)|
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
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
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
Protein c-Fos/Transcription factor Jun


(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 |wU:14.24,(-7.53,4.55,;-6,4.62,;-5.29,5.99,;-5.17,3.32,;-3.63,3.39,;-2.8,2.1,;-1.26,2.17,;-.42,.88,;1.12,.95,;1.82,2.31,;1,3.6,;-.54,3.53,;2.67,3.6,;4.15,3.19,;4.22,1.65,;2.78,1.11,;2.37,-.38,;.88,-.77,;3.45,-1.47,;3.05,-2.96,;4.13,-4.05,;3.72,-5.54,;5.62,-3.66,;5.51,.8,;6.88,1.49,;5.42,-.73,)|
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
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
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