PatGlueDB | Molecular Glue Patent Bioactivity Database

2D structure

Cc1sc2ncnc(N3CCN(Cc4ccc5c(c4)CN(N4CCC(=O)NC4=O)C5=O)CC3)c2c1C

Compound summary

Compound IDPGDB_C014326

FormulaC25H27N7O3S

Molecular weight505.604

InChIKeyQXOBXGNFKYXWRD-UHFFFAOYSA-N

Physicochemical properties

Exact mass505.1896

RDKit cLogP2.44

TPSA102

HBD / HBA1 / 8

Rotatable bonds4

Heavy atoms36

Hetero atoms11

Rings / aromatic6 / 3

Fraction Csp30.4

Formal charge0

Fragments1

Activity compounds and values

Activity records

10 records

	Control		Value		Concentration	Time					Record ID	Compound	Assay	Details
% Degradation	-	<	20	%	Concentration series: 500 nM, 50 nM	24 h	CSNK1A1	-	-	WO2024245444A1	PGDB_A020019	PGDB_C014326	PGDB_AS000339	View
% Degradation	-	<	20	%	Concentration series: 500 nM, 50 nM	24 h	GSPT1	-	-	WO2024245444A1	PGDB_A020795	PGDB_C014326	PGDB_AS001137	View
% Degradation	-	<	20	%	Concentration series: 500 nM, 50 nM	24 h	WEE1	-	-	WO2024245444A1	PGDB_A026236	PGDB_C014326	PGDB_AS001444	View
% Inhibition	-	=	25-30	%	500 nM	-	-	-	H2228	WO2024245444A1	PGDB_A029005	PGDB_C014326	PGDB_AS000051	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF2	-	-	WO2024245444A1	PGDB_A033592	PGDB_C014326	PGDB_AS002298	View
% Inhibition	-	=	10-15	%	10 nM	-	-	-	H2228	WO2024245444A1	PGDB_A047127	PGDB_C014326	PGDB_AS001356	View
% Inhibition	-	=	10-15	%	10 nM	-	-	-	MDA-MB-231	WO2024245444A1	PGDB_A049960	PGDB_C014326	PGDB_AS002156	View
% Inhibition	-	=	18-25	%	500 nM	-	-	-	MDA-MB-231	WO2024245444A1	PGDB_A060439	PGDB_C014326	PGDB_AS002131	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF3	-	-	WO2024245444A1	PGDB_A065302	PGDB_C014326	PGDB_AS001967	View
% Degradation	-	<	20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF1	-	-	WO2024245444A1	PGDB_A066499	PGDB_C014326	PGDB_AS000969	View

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