PatGlueDB | Molecular Glue Patent Bioactivity Database

2D structure

O=C1CCC(N2Cc3c(OCc4ccc(CN5CCOCC5)cc4)cccc3C2=O)C(=O)N1

Compound summary

Compound IDPGDB_C001722

FormulaC25H27N3O5

Molecular weight449.507

InChIKeyIXZOHGPZAQLIBH-UHFFFAOYSA-N

Physicochemical properties

Exact mass449.1951

RDKit cLogP1.86

TPSA88.2

HBD / HBA1 / 6

Rotatable bonds6

Heavy atoms33

Hetero atoms8

Rings / aromatic5 / 2

Fraction Csp30.4

Formal charge0

Fragments1

Activity compounds and values

Activity records

15 records

	Control		Value		Concentration	Time					Record ID	Compound	Assay	Details
IC50	-	=	0.01	uM	-	—	-	-	-	JP6306592B2	PGDB_A009506	PGDB_C001722	PGDB_AS000129	View
Relative activity	control	=	372	%	-	-	-	-	-	JP6306592B2	PGDB_A010957	PGDB_C001722	PGDB_AS002248	View
IC50	-	=	0.0092	uM	-	—	-	-	-	JP6306592B2	PGDB_A019105	PGDB_C001722	PGDB_AS001022	View
IC50	-	>	10	uM	-	—	-	-	-	JP6306592B2	PGDB_A022252	PGDB_C001722	PGDB_AS002404	View
Relative activity	control	=	208	%	-	-	-	-	-	JP6306592B2	PGDB_A026418	PGDB_C001722	PGDB_AS002413	View
IC50	-	=	0.0026	uM	-	—	-	-	-	JP6306592B2	PGDB_A028613	PGDB_C001722	PGDB_AS000318	View
IC50	-	>	10	uM	-	—	-	-	-	JP6306592B2	PGDB_A037472	PGDB_C001722	PGDB_AS001058	View
IC50	-	=	0.00085	uM	-	—	-	-	-	JP6306592B2	PGDB_A042942	PGDB_C001722	PGDB_AS001247	View
IC50	-	=	0.0018	uM	-	—	-	-	-	JP6306592B2	PGDB_A048101	PGDB_C001722	PGDB_AS000268	View
IC50	-	=	0.19	uM	-	—	-	-	-	JP6306592B2	PGDB_A053354	PGDB_C001722	PGDB_AS001172	View
Relative activity	control	=	153	%	-	-	-	-	-	JP6306592B2	PGDB_A053459	PGDB_C001722	PGDB_AS001193	View
IC50	-	>	20	uM	-	—	-	-	MV-4-11	WO2020114482A1	PGDB_A056276	PGDB_C001722	PGDB_AS001277	View
% Inhibition	-	>	20	%	-	7 d	-	-	MV-4-11	WO2020064002A1	PGDB_A063906	PGDB_C001722	PGDB_AS001761	View
IC50	-	<	150	nM	-	—	-	-	Mino	WO2020114482A1	PGDB_A064789	PGDB_C001722	PGDB_AS000154	View
IC50	-	<	150	nM	-	—	-	-	MM.1S	WO2020114482A1	PGDB_A074428	PGDB_C001722	PGDB_AS001188	View

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