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BDBM50235639 CHEMBL4062773

SMILES: CN(C)[C@H]1CN(C[C@@H]1c1cn(C)c2ccccc12)[C@H]1CCc2ccc(F)cc12

InChI Key: InChIKey=NPQDXPQRBHDPNH-NHTMILBNSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50235639   
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
Polycomb protein EED (EED)


(Homo sapiens (Human))		BDBM50235639
PNG
(CHEMBL4062773)
Show SMILES CN(C)[C@H]1CN(C[C@@H]1c1cn(C)c2ccccc12)[C@H]1CCc2ccc(F)cc12 |r|
Show InChI InChI=1S/C24H28FN3/c1-26(2)24-15-28(23-11-9-16-8-10-17(25)12-19(16)23)14-21(24)20-13-27(3)22-7-5-4-6-18(20)22/h4-8,10,12-13,21,23-24H,9,11,14-15H2,1-3H3/t21-,23+,24+/m1/s1
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Article
PubMed
 66n/an/an/an/an/an/an/an/a



AbbVie Inc.

Curated by ChEMBL


Assay Description
Inhibition of OG(488) labeled probe binding to GST-tagged EED (unknown origin) after 1 hr by LanthaScreen TR-FRET assay

Bioorg Med Chem Lett 27: 1576-1583 (2017)


Article DOI: 10.1016/j.bmcl.2017.02.030
BindingDB Entry DOI: 10.7270/Q22F7QQG
More data for this
Ligand-Target Pair