PatGlueDB | Molecular Glue Patent Bioactivity Database

2D structure

O=C1CCN(N2C(=O)c3ccc(CN4CCC(c5ncnc6scc(-c7ccccc7)c56)CC4)cc3C2=O)C(=O)N1

Compound summary

Compound IDPGDB_C023624

FormulaC30H26N6O4S

Molecular weight566.643

InChIKeyISDLRSFFTGEGEV-UHFFFAOYSA-N

Physicochemical properties

Exact mass566.1736

RDKit cLogP4.19

TPSA115.8

HBD / HBA1 / 8

Rotatable bonds5

Heavy atoms41

Hetero atoms11

Rings / aromatic7 / 4

Fraction Csp30.27

Formal charge0

Fragments1

Activity compounds and values

Activity records

10 records

	Control		Value		Concentration	Time					Record ID	Compound	Assay	Details
% Inhibition	-	=	5-10	%	500 nM	-	-	-	MDA-MB-231	WO2024245444A1	PGDB_A013229	PGDB_C023624	PGDB_AS002131	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	CSNK1A1	-	-	WO2024245444A1	PGDB_A016373	PGDB_C023624	PGDB_AS000339	View
% Inhibition	-	=	18-25	%	10 nM	-	-	-	MDA-MB-231	WO2024245444A1	PGDB_A018301	PGDB_C023624	PGDB_AS002156	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF2	-	-	WO2024245444A1	PGDB_A034181	PGDB_C023624	PGDB_AS002298	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	GSPT1	-	-	WO2024245444A1	PGDB_A041736	PGDB_C023624	PGDB_AS001137	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	WEE1	-	-	WO2024245444A1	PGDB_A053181	PGDB_C023624	PGDB_AS001444	View
% Inhibition	-	=	1-5	%	500 nM	-	-	-	H292	WO2024245444A1	PGDB_A058465	PGDB_C023624	PGDB_AS000415	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF1	-	-	WO2024245444A1	PGDB_A062278	PGDB_C023624	PGDB_AS000969	View
% Inhibition	-	=	15-20	%	10 nM	-	-	-	H292	WO2024245444A1	PGDB_A067845	PGDB_C023624	PGDB_AS001605	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF3	-	-	WO2024245444A1	PGDB_A074193	PGDB_C023624	PGDB_AS001967	View

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