PatGlueDB | Molecular Glue Patent Bioactivity Database

2D structure

O=C1CCC(N2Cc3c(CN4CC(C5CCOc6cc(F)ccc65)C4)cccc3C2=S)C(=O)N1

Compound summary

Compound IDPGDB_C022246

FormulaC26H26FN3O3S

Molecular weight479.577

InChIKeyWLGWBDRKOGNFLC-UHFFFAOYSA-N

Physicochemical properties

Exact mass479.1679

RDKit cLogP3.12

TPSA61.9

HBD / HBA1 / 5

Rotatable bonds4

Heavy atoms34

Hetero atoms8

Rings / aromatic6 / 2

Fraction Csp30.42

Formal charge0

Fragments1

Activity compounds and values

Activity records

12 records

	Control		Value		Concentration	Time					Record ID	Compound	Assay	Details
% Inhibition	-	=	50-60	%	500 nM	-	-	-	MM.1S	CN119654316A	PGDB_A082234	PGDB_C022246	PGDB_AS000639	View
% Inhibition	-	=	50-60	%	10 nM	-	-	-	MCF-7	CN119654316A	PGDB_A082464	PGDB_C022246	PGDB_AS002350	View
% Inhibition	-	=	40-50	%	500 nM	-	-	-	MCF-7	CN119654316A	PGDB_A082577	PGDB_C022246	PGDB_AS001118	View
% Degradation	-	=	80-100	%	-	-	IKZF1	-	-	CN119654316A	PGDB_A082605	PGDB_C022246	PGDB_AS001680	View
% Degradation	-	=	80-100	%	-	-	-	-	-	CN119654316A	PGDB_A082669	PGDB_C022246	PGDB_AS000466	View
% Degradation	-	=	80-100	%	-	-	IKZF2	-	-	CN119654316A	PGDB_A082969	PGDB_C022246	PGDB_AS002430	View
% Degradation	-	=	80-100	%	-	-	IKZF3	-	-	CN119654316A	PGDB_A083077	PGDB_C022246	PGDB_AS000017	View
% Degradation	-	=	80-100	%	-	-	WEE1	-	-	CN119654316A	PGDB_A083296	PGDB_C022246	PGDB_AS001023	View
% Inhibition	-	=	30-40	%	10 nM	-	-	-	MM.1S	CN119654316A	PGDB_A083839	PGDB_C022246	PGDB_AS000042	View
% Inhibition	-	=	40-53	%	0.5 uM	3 h	CRBN	CRBN	-	CN119654316A	PGDB_A084315	PGDB_C022246	PGDB_AS001405	View
% Inhibition	-	=	60-80	%	2 uM	3 h	CRBN	CRBN	-	CN119654316A	PGDB_A084603	PGDB_C022246	PGDB_AS002552	View
% Degradation	-	=	0-80	%	-	-	GSPT1	-	-	CN119654316A	PGDB_A085574	PGDB_C022246	PGDB_AS000660	View

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