PatGlueDB | Molecular Glue Patent Bioactivity Database

2D structure

O=C1CCN(N2Cc3cc(CN4CCC(N(c5ccccc5)c5ccccn5)CC4)ccc3C2=O)C(=O)N1

Compound summary

Compound IDPGDB_C023601

FormulaC29H30N6O3

Molecular weight510.598

InChIKeyFUHRFFNYETYODP-UHFFFAOYSA-N

Physicochemical properties

Exact mass510.2379

RDKit cLogP3.7

TPSA89.1

HBD / HBA1 / 6

Rotatable bonds6

Heavy atoms38

Hetero atoms9

Rings / aromatic6 / 3

Fraction Csp30.31

Formal charge0

Fragments1

Activity compounds and values

Activity records

9 records

	Control		Value		Concentration	Time					Record ID	Compound	Assay	Details
IC50	-	=	50-100	nM	-	—	-	-	MM.1S	WO2024245444A1	PGDB_A008094	PGDB_C023601	PGDB_AS001978	View
IC50	-	=	100-500	nM	-	—	-	-	Jurkat	WO2024245444A1	PGDB_A023867	PGDB_C023601	PGDB_AS001634	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF1	-	-	WO2024245444A1	PGDB_A034240	PGDB_C023601	PGDB_AS000969	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF3	-	-	WO2024245444A1	PGDB_A036844	PGDB_C023601	PGDB_AS001967	View
IC50	-	=	100-500	nM	-	—	-	-	MGC-803	WO2024245444A1	PGDB_A038345	PGDB_C023601	PGDB_AS000874	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	CSNK1A1	-	-	WO2024245444A1	PGDB_A041379	PGDB_C023601	PGDB_AS000339	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF2	-	-	WO2024245444A1	PGDB_A044489	PGDB_C023601	PGDB_AS002298	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	GSPT1	-	-	WO2024245444A1	PGDB_A047459	PGDB_C023601	PGDB_AS001137	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	WEE1	-	-	WO2024245444A1	PGDB_A051295	PGDB_C023601	PGDB_AS001444	View

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