PatGlueDB | Molecular Glue Patent Bioactivity Database

2D structure

Cc1nc(C2=CCN(Cc3ccc4c(c3)C(=O)N(N3CCC(=O)NC3=O)C4=O)CC2)c2c3c(sc2n1)CCCC3

Compound summary

Compound IDPGDB_C014298

FormulaC29H28N6O4S

Molecular weight556.648

InChIKeyTWCFQXWIICRMJQ-UHFFFAOYSA-N

Physicochemical properties

Exact mass556.1893

RDKit cLogP3.62

TPSA115.8

HBD / HBA1 / 8

Rotatable bonds4

Heavy atoms40

Hetero atoms11

Rings / aromatic7 / 3

Fraction Csp30.38

Formal charge0

Fragments1

Activity compounds and values

Activity records

8 records

	Control		Value		Concentration	Time					Record ID	Compound	Assay	Details
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	GSPT1	-	-	WO2024245444A1	PGDB_A009041	PGDB_C014298	PGDB_AS001137	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	CSNK1A1	-	-	WO2024245444A1	PGDB_A010915	PGDB_C014298	PGDB_AS000339	View
% Degradation	-	<	20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF1	-	-	WO2024245444A1	PGDB_A025204	PGDB_C014298	PGDB_AS000969	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF3	-	-	WO2024245444A1	PGDB_A033129	PGDB_C014298	PGDB_AS001967	View
% Degradation	-	<	20	%	Concentration series: 500 nM, 50 nM	24 h	WEE1	-	-	WO2024245444A1	PGDB_A039854	PGDB_C014298	PGDB_AS001444	View
% Degradation	-	<	20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF2	-	-	WO2024245444A1	PGDB_A045501	PGDB_C014298	PGDB_AS002298	View
% Inhibition	-	=	20-40	%	500 nM	-	-	-	H292	WO2024245444A1	PGDB_A048795	PGDB_C014298	PGDB_AS000415	View
% Inhibition	-	=	20-40	%	10 nM	-	-	-	H292	WO2024245444A1	PGDB_A071507	PGDB_C014298	PGDB_AS001605	View

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