PatGlueDB | Molecular Glue Patent Bioactivity Database

2D structure

CC(=O)NC(=O)C(C)N1Cc2cc(CN3CCN(c4cccc(Br)c4)CC3)ccc2C1=S

Compound summary

Compound IDPGDB_C022079

FormulaC24H27BrN4O2S

Molecular weight515.477

InChIKeyNYKLMEIYXQBIJU-UHFFFAOYSA-N

Physicochemical properties

Exact mass514.1038

RDKit cLogP3.31

TPSA55.9

HBD / HBA1 / 5

Rotatable bonds5

Heavy atoms32

Hetero atoms8

Rings / aromatic4 / 2

Fraction Csp30.38

Formal charge0

Fragments1

Activity compounds and values

Activity records

16 records

	Control		Value		Concentration	Time					Record ID	Compound	Assay	Details
% Inhibition	-	=	60-80	%	2 uM	3 h	CRBN	CRBN	-	CN119654316A	PGDB_A082286	PGDB_C022079	PGDB_AS002552	View
% Inhibition	-	=	30-40	%	10 nM	96 h	-	-	MOLT-4	CN119654316A	PGDB_A082451	PGDB_C022079	PGDB_AS002038	View
% Inhibition	-	=	80-100	%	500 nM	-	-	-	MV-4-11	CN119654316A	PGDB_A082568	PGDB_C022079	PGDB_AS001323	View
% Degradation	-	=	80-100	%	-	-	WEE1	-	-	CN119654316A	PGDB_A082835	PGDB_C022079	PGDB_AS001023	View
% Inhibition	-	=	70-80	%	10 nM	-	-	-	MM.1S	CN119654316A	PGDB_A083046	PGDB_C022079	PGDB_AS000042	View
% Degradation	-	=	0-80	%	-	-	GSPT1	-	-	CN119654316A	PGDB_A083254	PGDB_C022079	PGDB_AS000660	View
% Degradation	-	=	80-100	%	-	-	-	-	-	CN119654316A	PGDB_A084082	PGDB_C022079	PGDB_AS000466	View
% Degradation	-	=	80-100	%	-	-	IKZF3	-	-	CN119654316A	PGDB_A084344	PGDB_C022079	PGDB_AS000017	View
% Degradation	-	=	80-100	%	-	-	IKZF2	-	-	CN119654316A	PGDB_A084457	PGDB_C022079	PGDB_AS002430	View
% Inhibition	-	=	70-80	%	500 nM	-	-	-	MM.1S	CN119654316A	PGDB_A084719	PGDB_C022079	PGDB_AS000639	View
% Inhibition	-	=	50-60	%	500 nM	96 h	-	-	RPMI-8226	CN119654316A	PGDB_A084734	PGDB_C022079	PGDB_AS000560	View
% Inhibition	-	=	20-30	%	10 nM	96 h	-	-	RPMI-8226	CN119654316A	PGDB_A084748	PGDB_C022079	PGDB_AS001289	View
% Degradation	-	=	80-100	%	-	-	IKZF1	-	-	CN119654316A	PGDB_A084949	PGDB_C022079	PGDB_AS001680	View
% Inhibition	-	=	80-100	%	500 nM	96 h	-	-	MOLT-4	CN119654316A	PGDB_A085250	PGDB_C022079	PGDB_AS000121	View
% Inhibition	-	=	5-10	%	10 nM	-	-	-	MV-4-11	CN119654316A	PGDB_A085288	PGDB_C022079	PGDB_AS000053	View
% Inhibition	-	=	40-53	%	0.5 uM	3 h	CRBN	CRBN	-	CN119654316A	PGDB_A085395	PGDB_C022079	PGDB_AS001405	View

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