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BDBM50341833 (S)-2-amino-N-((S)-1-(5-(ethyl(methyl)amino)pentylamino)-1-oxo-3-phenylpropan-2-yl)-3-(1H-imidazol-4-yl)propanamide::CHEMBL1767020

SMILES: CCN(C)CCCCCNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1cnc[nH]1

InChI Key: InChIKey=CKEQDVRUHBABNQ-SFTDATJTSA-N

Data: 1 Kd

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50341833   
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
Lethal(3)malignant brain tumor-like protein 1 (L3MBTL1)


(Homo sapiens (Human))
BDBM50341833
PNG
((S)-2-amino-N-((S)-1-(5-(ethyl(methyl)amino)pentyl...)
Show SMILES CCN(C)CCCCCNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1cnc[nH]1 |r|
Show InChI InChI=1S/C23H36N6O2/c1-3-29(2)13-9-5-8-12-26-23(31)21(14-18-10-6-4-7-11-18)28-22(30)20(24)15-19-16-25-17-27-19/h4,6-7,10-11,16-17,20-21H,3,5,8-9,12-15,24H2,1-2H3,(H,25,27)(H,26,31)(H,28,30)/t20-,21-/m0/s1
PDB

KEGG

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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 7.80E+4n/an/an/an/an/a



University of North Carolina at Chapel Hill

Curated by ChEMBL


Assay Description
Binding affinity to human L3MBTL1 assessed as dissociation constant by isothermal titration calorimetric assay


J Med Chem 54: 2504-11 (2011)


Article DOI: 10.1021/jm200045v
BindingDB Entry DOI: 10.7270/Q2HH6KCP
More data for this
Ligand-Target Pair