PatGlueDB | Molecular Glue Patent Bioactivity Database

2D structure

C[C@H](NC(=O)c1ccccc1)C(=O)Nc1ccc2c(c1)CN(C1CCC(=O)NC1=O)C2=O

Compound summary

Compound IDPGDB_C002849

FormulaC23H22N4O5

Molecular weight434.452

InChIKeyPDSQZCRQLLEYQG-FVRDMJKUSA-N

Physicochemical properties

Exact mass434.159

RDKit cLogP1.2

TPSA124.7

HBD / HBA3 / 5

Rotatable bonds5

Heavy atoms32

Hetero atoms9

Rings / aromatic4 / 2

Fraction Csp30.26

Formal charge0

Fragments1

Activity compounds and values

Activity records

11 records

	Control		Value		Concentration	Time					Record ID	Compound	Assay	Details
DC50	-	=	72	nM	-	—	IKZF1	-	NCI-H1155	WO2024059107A1	PGDB_A008514	PGDB_C002849	PGDB_AS001115	View
% Degradation	-	=	18.2	%	100 nM	-	CSNK1A1	-	-	WO2024059107A1	PGDB_A012154	PGDB_C002849	PGDB_AS000209	View
Dmax	-	=	80.5	%	-	72 h	IKZF2	-	NCI-H1155	WO2024059107A1	PGDB_A012342	PGDB_C002849	PGDB_AS000259	View
% Degradation	-	=	5.5	%	100 nM	-	GSPT1	-	-	WO2024059107A1	PGDB_A018609	PGDB_C002849	PGDB_AS002431	View
% Degradation	-	=	6.2	%	1 uM	-	GSPT1	-	-	WO2024059107A1	PGDB_A018807	PGDB_C002849	PGDB_AS001974	View
% Degradation	-	=	41.2	%	1 uM	-	CSNK1A1	-	-	WO2024059107A1	PGDB_A035299	PGDB_C002849	PGDB_AS000685	View
Dmax	-	=	54.1	%	-	-	CSNK1A1	-	-	WO2024059107A1	PGDB_A048069	PGDB_C002849	PGDB_AS002567	View
DC50	-	=	175.2	nM	-	—	CSNK1A1	-	NCI-H1155	WO2024059107A1	PGDB_A051247	PGDB_C002849	PGDB_AS002387	View
Dmax	-	=	0	%	-	72 h	GSPT1	-	NCI-H1155	WO2024059107A1	PGDB_A060488	PGDB_C002849	PGDB_AS001612	View
Dmax	-	=	88	%	-	72 h	IKZF1	-	NCI-H1155	WO2024059107A1	PGDB_A066112	PGDB_C002849	PGDB_AS002425	View
DC50	-	=	142.8	nM	-	—	IKZF2	-	NCI-H1155	WO2024059107A1	PGDB_A075922	PGDB_C002849	PGDB_AS002270	View

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