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BDBM50009524 CHEMBL3234439

SMILES: COC(=O)c1ccc(cc1)S(=O)(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCC[N+](C)(C)C)C(=O)N[C@@H](CO)C(N)=O

InChI Key: InChIKey=IMQMEJJPYCRMCV-PKAIDYEGSA-O

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50009524   
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
Chromobox protein homolog 7 (CBX7)


(Homo sapiens (Human))
BDBM50009524
PNG
(CHEMBL3234439)
Show SMILES COC(=O)c1ccc(cc1)S(=O)(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCC[N+](C)(C)C)C(=O)N[C@@H](CO)C(N)=O |r|
Show InChI InChI=1S/C38H57N7O10S/c1-24(2)21-30(36(50)41-29(15-11-12-20-45(4,5)6)35(49)43-32(23-46)33(39)47)42-34(48)25(3)40-37(51)31(22-26-13-9-8-10-14-26)44-56(53,54)28-18-16-27(17-19-28)38(52)55-7/h8-10,13-14,16-19,24-25,29-32,44,46H,11-12,15,20-23H2,1-7H3,(H5-,39,40,41,42,43,47,48,49,50,51)/p+1/t25-,29-,30-,31-,32-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 5.70E+4n/an/an/an/an/an/a



University of Victoria

Curated by ChEMBL


Assay Description
Displacement of FITC-labeled H3K27me3 from CBX7 (unknown origin) after 15 mins by fluorescence polarization assay


J Med Chem 57: 2874-83 (2014)


Article DOI: 10.1021/jm401487x
BindingDB Entry DOI: 10.7270/Q2571DJ3
More data for this
Ligand-Target Pair