PatGlueDB | Molecular Glue Patent Bioactivity Database

2D structure

O=C1CCC(N2Cc3c(CN4C5CCC4CN(c4cccc(Cl)c4Cl)C5)cccc3C2=S)C(=O)N1

Compound summary

Compound IDPGDB_C022100

FormulaC26H26Cl2N4O2S

Molecular weight529.493

InChIKeyIFWXDOXEUBWKFI-UHFFFAOYSA-N

Physicochemical properties

Exact mass528.1154

RDKit cLogP4.14

TPSA55.9

HBD / HBA1 / 5

Rotatable bonds4

Heavy atoms35

Hetero atoms9

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	-	=	40-50	%	10 nM	-	-	-	MM.1S	CN119654316A	PGDB_A082250	PGDB_C022100	PGDB_AS000042	View
% Degradation	-	=	0-80	%	-	-	GSPT1	-	-	CN119654316A	PGDB_A082275	PGDB_C022100	PGDB_AS000660	View
% Degradation	-	=	80-100	%	-	-	IKZF2	-	-	CN119654316A	PGDB_A082688	PGDB_C022100	PGDB_AS002430	View
% Degradation	-	=	80-100	%	-	-	-	-	-	CN119654316A	PGDB_A082826	PGDB_C022100	PGDB_AS000466	View
% Inhibition	-	=	20-30	%	0.5 uM	3 h	CRBN	CRBN	-	CN119654316A	PGDB_A083439	PGDB_C022100	PGDB_AS001405	View
% Inhibition	-	=	53-60	%	2 uM	3 h	CRBN	CRBN	-	CN119654316A	PGDB_A084169	PGDB_C022100	PGDB_AS002552	View
% Inhibition	-	=	40-60	%	500 nM	-	-	-	MV-4-11	CN119654316A	PGDB_A084172	PGDB_C022100	PGDB_AS001323	View
% Inhibition	-	=	40-60	%	10 nM	-	-	-	MV-4-11	CN119654316A	PGDB_A084284	PGDB_C022100	PGDB_AS000053	View
% Degradation	-	=	80-100	%	-	-	IKZF3	-	-	CN119654316A	PGDB_A084657	PGDB_C022100	PGDB_AS000017	View
% Inhibition	-	=	40-50	%	500 nM	-	-	-	MM.1S	CN119654316A	PGDB_A084770	PGDB_C022100	PGDB_AS000639	View
% Degradation	-	=	80-100	%	-	-	IKZF1	-	-	CN119654316A	PGDB_A084831	PGDB_C022100	PGDB_AS001680	View
% Degradation	-	=	80-100	%	-	-	WEE1	-	-	CN119654316A	PGDB_A085753	PGDB_C022100	PGDB_AS001023	View

Rows per pagePage 1 of 1 · 12 recordsGo to page