PatGlueDB | Molecular Glue Patent Bioactivity Database

2D structure

O=C1CC[C@H](N2Cc3cc(O[C@H]4CN(Cc5cc(F)c6nc(C7CCOCC7)ccc6c5)C[C@@H]4C4CCCC4)ccc3C2=O)C(=O)N1

Compound summary

Compound IDPGDB_C011241

FormulaC37H41FN4O5

Molecular weight640.756

InChIKeyOKAMHWTURLMKRO-CDSZWMAJSA-N

Physicochemical properties

Exact mass640.3061

RDKit cLogP5.1

TPSA101.1

HBD / HBA1 / 7

Rotatable bonds7

Heavy atoms47

Hetero atoms10

Rings / aromatic8 / 3

Fraction Csp30.51

Formal charge0

Fragments1

Activity compounds and values

Activity records

12 records

	Control		Value		Concentration	Time					Record ID	Compound	Assay	Details
EC50	-	=	0.585	uM	-	—	WEE1	-	MDA-MB-231	WO2025137053A1	PGDB_A008370	PGDB_C011241	PGDB_AS001832	View
EC50	-	=	1	uM	-	—	WEE1	-	293T-LentiXWEE1-ePL	WO2025137053A1	PGDB_A019434	PGDB_C011241	PGDB_AS001798	View
EC50	-	=	0.001	uM	-	—	WEE1	-	293T-LentiXWEE1-ePL	WO2025137053A1	PGDB_A032147	PGDB_C011241	PGDB_AS001798	View
EC50	-	=	0.003	uM	-	—	WEE1	-	MKN45	WO2025137053A1	PGDB_A036734	PGDB_C011241	PGDB_AS002043	View
Ymin	-	=	10.8	%	Concentration series: 1 uM, 10 uM	120 h	WEE1	-	MKN45	WO2025137053A1	PGDB_A038864	PGDB_C011241	PGDB_AS000997	View
Ymin	-	=	50.7	%	Concentration series: 1 uM, 10 uM	120 h	WEE1	-	MDA-MB-231	WO2025137053A1	PGDB_A040170	PGDB_C011241	PGDB_AS002525	View
Ymin	-	=	93.2	%	Concentration series: 1 uM, 10 uM	4 h	WEE1	-	293T-LentiXWEE1-ePL	WO2025137053A1	PGDB_A041544	PGDB_C011241	PGDB_AS001848	View
Ymin	-	=	79.7	%	Concentration series: 1 uM, 10 uM	120 h	WEE1	-	MDA-MB-231	WO2025137053A1	PGDB_A049605	PGDB_C011241	PGDB_AS002525	View
Ymin	-	=	24.2	%	Concentration series: 1 uM, 10 uM	4 h	WEE1	-	293T-LentiXWEE1-ePL	WO2025137053A1	PGDB_A052782	PGDB_C011241	PGDB_AS001848	View
EC50	-	=	0.308	uM	-	—	WEE1	-	MKN45	WO2025137053A1	PGDB_A055278	PGDB_C011241	PGDB_AS002043	View
EC50	-	=	0.443	uM	-	—	WEE1	-	MDA-MB-231	WO2025137053A1	PGDB_A057287	PGDB_C011241	PGDB_AS001832	View
Ymin	-	=	92.2	%	Concentration series: 1 uM, 10 uM	120 h	WEE1	-	MKN45	WO2025137053A1	PGDB_A058949	PGDB_C011241	PGDB_AS000997	View

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