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BDBM50151079 (S)-3-{(S)-2-[(S)-2-((S)-2-{(S)-2-[(S)-2-(2-Amino-acetylamino)-4-carbamoyl-butyrylamino]-4-methyl-pentanoylamino}-3-carboxy-propionylamino)-4-methyl-pentanoylamino]-propionylamino}-N-carboxymethyl-succinamic acid::CHEMBL186600

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

InChI Key: InChIKey=VGLRIGYUTMVQGT-PXQJOHHUSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50151079   
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
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
PDB

KEGG

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UniProtKB/TrEMBL

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PC cid
PC sid
UniChem

Similars

Article
PubMed
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