PatGlueDB | Molecular Glue Patent Bioactivity Database

2D structure

O=C1CCC(N2C(=O)c3cccc(CN4CCC(N5CCN(C(c6ccccc6)c6ccccc6)CC5)CC4)c3C2=O)C(=O)N1

Compound summary

Compound IDPGDB_C000791

FormulaC36H39N5O4

Molecular weight605.739

InChIKeyKWUZQTHGMVLTLK-UHFFFAOYSA-N

Physicochemical properties

Exact mass605.3002

RDKit cLogP3.46

TPSA93.3

HBD / HBA1 / 7

Rotatable bonds7

Heavy atoms45

Hetero atoms9

Rings / aromatic7 / 3

Fraction Csp30.39

Formal charge0

Fragments1

Activity compounds and values

Activity records

14 records

	Control		Value		Concentration	Time					Record ID	Compound	Assay	Details
% Inhibition	-	=	60-70	%	1 uM	24 h	-	-	-	CN120548310A	PGDB_A008768	PGDB_C000791	PGDB_AS000296	View
% Degradation	-	=	0-20	%	Concentration series: 500 nM, 50 nM	24 h	GSPT1	-	-	CN120548310A	PGDB_A009996	PGDB_C000791	PGDB_AS001466	View
% Inhibition	-	=	30-40	%	0.1 uM	24 h	-	-	-	CN120548310A	PGDB_A013707	PGDB_C000791	PGDB_AS001714	View
% Inhibition	-	=	70-80	%	1 uM	24 h	-	-	-	CN120548310A	PGDB_A017107	PGDB_C000791	PGDB_AS000125	View
% Inhibition	-	=	-50-0	%	0.1 uM	24 h	-	-	-	CN120548310A	PGDB_A028687	PGDB_C000791	PGDB_AS000650	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF3	-	-	CN120548310A	PGDB_A028990	PGDB_C000791	PGDB_AS000102	View
% Inhibition	-	=	50-60	%	1 uM	24 h	-	-	-	CN120548310A	PGDB_A033046	PGDB_C000791	PGDB_AS000202	View
% Degradation	-	=	0-20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF2	-	-	CN120548310A	PGDB_A035535	PGDB_C000791	PGDB_AS002025	View
% Degradation	-	=	0-20	%	Concentration series: 500 nM, 50 nM	24 h	CSNK1A1	-	-	CN120548310A	PGDB_A036286	PGDB_C000791	PGDB_AS001449	View
% Inhibition	-	=	60-70	%	0.1 uM	24 h	-	-	-	CN120548310A	PGDB_A037431	PGDB_C000791	PGDB_AS000584	View
% Degradation	-	=	0-20	%	Concentration series: 500 nM, 50 nM	24 h	WEE1	-	-	CN120548310A	PGDB_A046710	PGDB_C000791	PGDB_AS001655	View
% Degradation	-	=	0-20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF1	-	-	CN120548310A	PGDB_A056140	PGDB_C000791	PGDB_AS000946	View
% Inhibition	-	=	10-20	%	0.1 uM	24 h	-	-	-	CN120548310A	PGDB_A062932	PGDB_C000791	PGDB_AS001835	View
% Inhibition	-	=	60-70	%	1 uM	24 h	-	-	-	CN120548310A	PGDB_A072467	PGDB_C000791	PGDB_AS001951	View

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