PatGlueDB | Molecular Glue Patent Bioactivity Database

2D structure

CCn1c(C2CC(C#CC(C)N3CCN(C)CC3)=CN=C2C(C)OC)c2c3cc(ccc31)-c1csc(n1)CC(NC(=O)C1CC1C)C(=O)N1NC(C(=O)OCC(C)(C)C2)C2CC1C2

Compound summary

Compound IDPGDB_C011624

FormulaC49H64N8O5S

Molecular weight877.169

InChIKeyCSUCEDSNKRPQQO-UHFFFAOYSA-N

Physicochemical properties

Exact mass876.472

RDKit cLogP5.57

TPSA133.6

HBD / HBA2 / 12

Rotatable bonds7

Heavy atoms63

Hetero atoms14

Rings / aromatic10 / 3

Fraction Csp30.61

Formal charge0

Fragments1

Activity compounds and values

Activity records

14 records

	Control		Value		Concentration	Time					Record ID	Compound	Assay	Details
IC50	-	=	1-10	nM	-	—	KRAS	-	NCI-H358	WO2025214350A1	PGDB_A009247	PGDB_C011624	PGDB_AS001442	View
IC50	-	=	1-10	nM	-	—	KRAS	-	-	WO2025214350A1	PGDB_A009797	PGDB_C011624	PGDB_AS002054	View
IC50	-	=	1-10	nM	-	—	KRAS	-	NCI-H358	WO2025214350A1	PGDB_A010677	PGDB_C011624	PGDB_AS001442	View
IC50	-	=	10-100	nM	-	—	KRAS	-	-	WO2025214350A1	PGDB_A011974	PGDB_C011624	PGDB_AS000928	View
IC50	-	=	10-100	nM	-	—	KRAS	-	-	WO2025214350A1	PGDB_A012700	PGDB_C011624	PGDB_AS001818	View
IC50	-	=	1-10	nM	-	—	-	-	AsPC-1	WO2025214350A1	PGDB_A015976	PGDB_C011624	PGDB_AS001410	View
IC50	-	=	10-100	nM	-	—	KRAS	-	-	WO2025214350A1	PGDB_A016355	PGDB_C011624	PGDB_AS002054	View
IC50	-	=	10-100	nM	-	—	KRAS	-	-	WO2025214350A1	PGDB_A020417	PGDB_C011624	PGDB_AS000307	View
IC50	-	=	1-10	nM	-	—	KRAS	-	-	WO2025214350A1	PGDB_A036648	PGDB_C011624	PGDB_AS001818	View
IC50	-	=	1-10	nM	-	—	-	-	AsPC-1	WO2025214350A1	PGDB_A043917	PGDB_C011624	PGDB_AS001410	View
IC50	-	=	1-10	nM	-	—	KRAS	-	-	WO2025214350A1	PGDB_A050468	PGDB_C011624	PGDB_AS000928	View
IC50	-	=	1-10	nM	-	—	KRAS	-	-	WO2025214350A1	PGDB_A060837	PGDB_C011624	PGDB_AS000791	View
IC50	-	=	10-100	nM	-	—	KRAS	-	-	WO2025214350A1	PGDB_A061440	PGDB_C011624	PGDB_AS000307	View
IC50	-	=	10-100	nM	-	—	KRAS	-	-	WO2025214350A1	PGDB_A062590	PGDB_C011624	PGDB_AS000791	View

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