PatGlueDB | Molecular Glue Patent Bioactivity Database

2D structure

O=C1CCC(c2c(Cl)cc(CNC(=O)C3(c4ccc5cn[nH]c5c4)CCOCC3)cc2Cl)C(=O)N1

Compound summary

Compound IDPGDB_C020304

FormulaC25H24Cl2N4O4

Molecular weight515.397

InChIKeyBITYGUQDRHUTJX-UHFFFAOYSA-N

Physicochemical properties

Exact mass514.1175

RDKit cLogP3.75

TPSA113.2

HBD / HBA3 / 5

Rotatable bonds5

Heavy atoms35

Hetero atoms10

Rings / aromatic5 / 3

Fraction Csp30.36

Formal charge0

Fragments1

Activity compounds and values

Activity records

12 records

	Control		Value		Concentration	Time					Record ID	Compound	Assay	Details
DC50	-	<	100	nM	-	—	NEK7	CRBN	-	WO2025024521A1	PGDB_A008777	PGDB_C020304	PGDB_AS000280	View
EC50	-	<	100	nM	-	—	CRBN	CRBN	-	WO2025024521A1	PGDB_A017044	PGDB_C020304	PGDB_AS000488	View
EC50	-	=	0.02	uM	-	—	CRBN	CRBN	-	WO2025024521A1	PGDB_A020069	PGDB_C020304	PGDB_AS001033	View
Dmax	-	=	96	%	Concentration series: 1 uM, 0.05 nM	24 h	NEK7	-	CAL-51	WO2025024521A1	PGDB_A034924	PGDB_C020304	PGDB_AS002061	View
Dmax	-	=	92	%	Concentration series: 1 uM, 0.05 nM	24 h	NEK7	-	CAL-51	WO2025024521A1	PGDB_A043966	PGDB_C020304	PGDB_AS002061	View
EC50	-	<=	100	nM	-	—	-	-	-	KR20260041885A	PGDB_A047899	PGDB_C020304	PGDB_AS000595	View
DC50	-	=	11	nM	-	—	NEK7	-	CAL-51	WO2025024521A1	PGDB_A052582	PGDB_C020304	PGDB_AS001365	View
EC50	-	=	0.19	uM	-	—	CRBN	CRBN	-	WO2025024521A1	PGDB_A056664	PGDB_C020304	PGDB_AS001033	View
Dmax	-	>	75	%	Concentration context: various concentrations	24 h	-	-	CAL-51	KR20260041885A	PGDB_A060417	PGDB_C020304	PGDB_AS000078	View
DC50	-	<=	100	nM	-	—	-	-	CAL-51	KR20260041885A	PGDB_A064496	PGDB_C020304	PGDB_AS000761	View
Dmax	-	>	75	%	-	-	NEK7	CRBN	-	WO2025024521A1	PGDB_A065552	PGDB_C020304	PGDB_AS002165	View
DC50	-	=	1	nM	-	—	NEK7	-	CAL-51	WO2025024521A1	PGDB_A068839	PGDB_C020304	PGDB_AS001365	View

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