PatGlueDB | Molecular Glue Patent Bioactivity Database

2D structure

CC(C)(C(=O)NCc1cc(Cl)c([C@@]2(F)CCC(=O)NC2=O)c(Cl)c1)c1ccccc1

Compound summary

Compound IDPGDB_C020447

FormulaC22H21Cl2FN2O3

Molecular weight451.325

InChIKeyBNYNSHQSTACUTA-QFIPXVFZSA-N

Physicochemical properties

Exact mass450.0913

RDKit cLogP4.19

TPSA75.3

HBD / HBA2 / 3

Rotatable bonds5

Heavy atoms30

Hetero atoms8

Rings / aromatic3 / 2

Fraction Csp30.32

Formal charge0

Fragments1

Activity compounds and values

Activity records

17 records

	Control		Value		Concentration	Time					Record ID	Compound	Assay	Details
DC50	-	=	1000	nM	-	—	CRBN	CRBN	-	WO2025024521A1	PGDB_A009379	PGDB_C020447	PGDB_AS000325	View
EC50	-	>	1000	nM	-	—	-	-	-	KR20260041885A	PGDB_A014891	PGDB_C020447	PGDB_AS000595	View
EC50	-	=	10	uM	-	—	CRBN	CRBN	-	WO2025024521A1	PGDB_A017923	PGDB_C020447	PGDB_AS000405	View
EC50	-	>	1000	nM	-	—	CRBN	CRBN	-	WO2025024521A1	PGDB_A022987	PGDB_C020447	PGDB_AS000488	View
Dmax	-	=	3	%	-	-	NEK7	CRBN	-	WO2025024521A1	PGDB_A025820	PGDB_C020447	PGDB_AS001956	View
DC50	-	=	5	nM	-	—	NEK7	-	CAL-51	WO2025024521A1	PGDB_A035757	PGDB_C020447	PGDB_AS001365	View
Dmax	-	=	1000	%	-	-	NEK7	CRBN	-	WO2025024521A1	PGDB_A038192	PGDB_C020447	PGDB_AS001553	View
DC50	-	>	1000	nM	-	—	NEK7	CRBN	-	WO2025024521A1	PGDB_A038433	PGDB_C020447	PGDB_AS000280	View
EC50	-	=	10	uM	-	—	CRBN	CRBN	-	WO2025024521A1	PGDB_A039643	PGDB_C020447	PGDB_AS001469	View
DC50	-	>	1000	nM	-	—	-	-	CAL-51	KR20260041885A	PGDB_A042594	PGDB_C020447	PGDB_AS000761	View
Dmax	-	=	95	%	Concentration series: 1 uM, 0.05 nM	24 h	NEK7	-	CAL-51	WO2025024521A1	PGDB_A044917	PGDB_C020447	PGDB_AS002061	View
Dmax	-	=	3	%	Concentration series: 1 uM, 0.05 nM	24 h	NEK7	-	CAL-51	WO2025024521A1	PGDB_A046276	PGDB_C020447	PGDB_AS002061	View
DC50	-	=	1000	nM	-	—	NEK7	-	CAL-51	WO2025024521A1	PGDB_A048379	PGDB_C020447	PGDB_AS001365	View
Dmax	-	=	3	%	-	-	NEK7	CRBN	-	WO2025024521A1	PGDB_A057782	PGDB_C020447	PGDB_AS002224	View
Dmax	-	<=	50	%	Concentration context: various concentrations	24 h	-	-	CAL-51	KR20260041885A	PGDB_A058392	PGDB_C020447	PGDB_AS000078	View
Dmax	-	<	50	%	-	-	NEK7	CRBN	-	WO2025024521A1	PGDB_A064832	PGDB_C020447	PGDB_AS002165	View
EC50	-	=	10	uM	-	—	CRBN	CRBN	-	WO2025024521A1	PGDB_A065682	PGDB_C020447	PGDB_AS001033	View

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