PatGlueDB | Molecular Glue Patent Bioactivity Database

2D structure

O=C1CCC(N2C(=O)c3ccc(CN4CCN(c5nc(N6CCCCC6)nc6c5SCC6)CC4)cc3C2=O)C(=O)N1

Compound summary

Compound IDPGDB_C019524

FormulaC29H33N7O4S

Molecular weight575.695

InChIKeySMPXJTALQPIZLO-UHFFFAOYSA-N

Physicochemical properties

Exact mass575.2315

RDKit cLogP1.84

TPSA119

HBD / HBA1 / 10

Rotatable bonds5

Heavy atoms41

Hetero atoms12

Rings / aromatic7 / 2

Fraction Csp30.52

Formal charge0

Fragments1

Activity compounds and values

Activity records

14 records

	Control		Value		Concentration	Time					Record ID	Compound	Assay	Details
% Degradation	-	>=	0	%	Concentration series: 500 nM, 50 nM	24 h	WEE1	-	-	WO2025016359A1	PGDB_A010653	PGDB_C019524	PGDB_AS000593	View
% Inhibition	-	=	30-40	%	500 nM	-	IKZF3	-	MDA-MB-231	WO2025016359A1	PGDB_A011432	PGDB_C019524	PGDB_AS000281	View
% Inhibition	-	=	90-100	%	500 nM	-	IKZF3	-	MOLT-4	WO2025016359A1	PGDB_A018248	PGDB_C019524	PGDB_AS001429	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF2	-	-	WO2025016359A1	PGDB_A022897	PGDB_C019524	PGDB_AS002547	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	GSPT1	-	-	WO2025016359A1	PGDB_A026146	PGDB_C019524	PGDB_AS000700	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF3	-	-	WO2025016359A1	PGDB_A033464	PGDB_C019524	PGDB_AS002465	View
% Inhibition	-	=	5-10	%	10 nM	-	IKZF3	-	Kasumi-1	WO2025016359A1	PGDB_A047460	PGDB_C019524	PGDB_AS001962	View
% Inhibition	-	=	20-30	%	10 nM	-	IKZF3	-	MOLT-4	WO2025016359A1	PGDB_A051884	PGDB_C019524	PGDB_AS002140	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	CSNK1A1	-	-	WO2025016359A1	PGDB_A058391	PGDB_C019524	PGDB_AS001647	View
% Inhibition	-	=	80-90	%	500 nM	-	IKZF3	-	Kasumi-1	WO2025016359A1	PGDB_A063712	PGDB_C019524	PGDB_AS000467	View
% Inhibition	-	=	30-40	%	10 nM	-	IKZF3	-	MDA-MB-231	WO2025016359A1	PGDB_A065934	PGDB_C019524	PGDB_AS000133	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF1	-	-	WO2025016359A1	PGDB_A071436	PGDB_C019524	PGDB_AS001760	View
% Inhibition	-	=	20-30	%	10 nM	-	IKZF3	-	CCRF-CEM	WO2025016359A1	PGDB_A074367	PGDB_C019524	PGDB_AS001627	View
% Inhibition	-	=	90-100	%	500 nM	-	IKZF3	-	CCRF-CEM	WO2025016359A1	PGDB_A074475	PGDB_C019524	PGDB_AS002504	View

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