PatGlueDB | Molecular Glue Patent Bioactivity Database

2D structure

O=C1CCN(N2C(=O)c3ccc(CN4CC=C(c5ncnc6sc7c(c56)CCCC7)CC4)cc3C2=O)C(=O)N1

Compound summary

Compound IDPGDB_C014299

FormulaC28H26N6O4S

Molecular weight542.621

InChIKeyUVSVIMAPWQYVSD-UHFFFAOYSA-N

Physicochemical properties

Exact mass542.1736

RDKit cLogP3.31

TPSA115.8

HBD / HBA1 / 8

Rotatable bonds4

Heavy atoms39

Hetero atoms11

Rings / aromatic7 / 3

Fraction Csp30.36

Formal charge0

Fragments1

Activity compounds and values

Activity records

10 records

	Control		Value		Concentration	Time					Record ID	Compound	Assay	Details
% Inhibition	-	=	20-40	%	10 nM	-	-	-	H292	WO2024245444A1	PGDB_A009984	PGDB_C014299	PGDB_AS001605	View
% Inhibition	-	=	15-20	%	500 nM	-	-	-	H292	WO2024245444A1	PGDB_A029112	PGDB_C014299	PGDB_AS000415	View
% Degradation	-	<	20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF2	-	-	WO2024245444A1	PGDB_A045480	PGDB_C014299	PGDB_AS002298	View
% Degradation	-	<	20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF1	-	-	WO2024245444A1	PGDB_A050003	PGDB_C014299	PGDB_AS000969	View
% Inhibition	-	=	30-42	%	500 nM	-	-	-	MM.1S	WO2024245444A1	PGDB_A053509	PGDB_C014299	PGDB_AS000503	View
% Inhibition	-	=	20-30	%	10 nM	-	-	-	MM.1S	WO2024245444A1	PGDB_A060211	PGDB_C014299	PGDB_AS001568	View
% Degradation	-	<	20	%	Concentration series: 500 nM, 50 nM	24 h	WEE1	-	-	WO2024245444A1	PGDB_A068483	PGDB_C014299	PGDB_AS001444	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	CSNK1A1	-	-	WO2024245444A1	PGDB_A069125	PGDB_C014299	PGDB_AS000339	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	GSPT1	-	-	WO2024245444A1	PGDB_A074813	PGDB_C014299	PGDB_AS001137	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF3	-	-	WO2024245444A1	PGDB_A076823	PGDB_C014299	PGDB_AS001967	View

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