PatGlueDB | Molecular Glue Patent Bioactivity Database

2D structure

O=C1CCN(N2Cc3cc(CN4CCN(c5ncnc6sccc56)CC4)ccc3C2=O)C(=O)N1

Compound summary

Compound IDPGDB_C014261

FormulaC23H23N7O3S

Molecular weight477.55

InChIKeyNPPPFPPJIIRXLD-UHFFFAOYSA-N

Physicochemical properties

Exact mass477.1583

RDKit cLogP1.83

TPSA102

HBD / HBA1 / 8

Rotatable bonds4

Heavy atoms34

Hetero atoms11

Rings / aromatic6 / 3

Fraction Csp30.35

Formal charge0

Fragments1

Activity compounds and values

Activity records

12 records

	Control		Value		Concentration	Time					Record ID	Compound	Assay	Details
% Inhibition	-	=	25-40	%	10 nM	-	-	-	MDA-MB-231	WO2024245444A1	PGDB_A015931	PGDB_C014261	PGDB_AS002156	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	GSPT1	-	-	WO2024245444A1	PGDB_A016043	PGDB_C014261	PGDB_AS001137	View
% Degradation	-	<	20	%	Concentration series: 500 nM, 50 nM	24 h	CSNK1A1	-	-	WO2024245444A1	PGDB_A023099	PGDB_C014261	PGDB_AS000339	View
% Inhibition	-	=	15-20	%	10 nM	-	-	-	H292	WO2024245444A1	PGDB_A037739	PGDB_C014261	PGDB_AS001605	View
% Inhibition	-	=	25-40	%	500 nM	-	-	-	MDA-MB-231	WO2024245444A1	PGDB_A040957	PGDB_C014261	PGDB_AS002131	View
% Inhibition	-	=	30-40	%	10 nM	-	-	-	H2228	WO2024245444A1	PGDB_A043006	PGDB_C014261	PGDB_AS001356	View
% Degradation	-	<	20	%	Concentration series: 500 nM, 50 nM	24 h	WEE1	-	-	WO2024245444A1	PGDB_A050447	PGDB_C014261	PGDB_AS001444	View
% Inhibition	-	=	15-20	%	500 nM	-	-	-	H292	WO2024245444A1	PGDB_A052318	PGDB_C014261	PGDB_AS000415	View
% Degradation	-	<	20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF3	-	-	WO2024245444A1	PGDB_A057712	PGDB_C014261	PGDB_AS001967	View
% Degradation	-	<	20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF2	-	-	WO2024245444A1	PGDB_A062244	PGDB_C014261	PGDB_AS002298	View
% Inhibition	-	=	20-25	%	500 nM	-	-	-	H2228	WO2024245444A1	PGDB_A067263	PGDB_C014261	PGDB_AS000051	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF1	-	-	WO2024245444A1	PGDB_A069173	PGDB_C014261	PGDB_AS000969	View

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