PatGlueDB | Molecular Glue Patent Bioactivity Database

2D structure

O=C1CCC(N2Cc3cc(CN4CCN(C5C=C(Cl)C=CC5Cl)CC4)ccc3C2=S)C(=O)N1

Compound summary

Compound IDPGDB_C022143

FormulaC24H26Cl2N4O2S

Molecular weight505.471

InChIKeyLAYBUQIEMMTXMG-UHFFFAOYSA-N

Physicochemical properties

Exact mass504.1154

RDKit cLogP2.77

TPSA55.9

HBD / HBA1 / 5

Rotatable bonds4

Heavy atoms33

Hetero atoms9

Rings / aromatic5 / 1

Fraction Csp30.46

Formal charge0

Fragments1

Activity compounds and values

Activity records

14 records

	Control		Value		Concentration	Time					Record ID	Compound	Assay	Details
% Degradation	-	=	0-80	%	-	-	GSPT1	-	-	CN119654316A	PGDB_A082389	PGDB_C022143	PGDB_AS000660	View
% Degradation	-	=	80-100	%	-	-	WEE1	-	-	CN119654316A	PGDB_A082768	PGDB_C022143	PGDB_AS001023	View
% Inhibition	-	=	53-60	%	2 uM	3 h	CRBN	CRBN	-	CN119654316A	PGDB_A082808	PGDB_C022143	PGDB_AS002552	View
% Inhibition	-	=	70-80	%	500 nM	96 h	-	-	MOLT-4	CN119654316A	PGDB_A083127	PGDB_C022143	PGDB_AS000121	View
% Inhibition	-	=	20-30	%	10 nM	-	-	-	MM.1S	CN119654316A	PGDB_A083245	PGDB_C022143	PGDB_AS000042	View
% Degradation	-	=	80-100	%	-	-	IKZF1	-	-	CN119654316A	PGDB_A083278	PGDB_C022143	PGDB_AS001680	View
% Inhibition	-	=	20-30	%	0.5 uM	3 h	CRBN	CRBN	-	CN119654316A	PGDB_A083541	PGDB_C022143	PGDB_AS001405	View
% Degradation	-	=	80-100	%	-	-	IKZF2	-	-	CN119654316A	PGDB_A083583	PGDB_C022143	PGDB_AS002430	View
% Degradation	-	=	80-100	%	-	-	IKZF3	-	-	CN119654316A	PGDB_A084403	PGDB_C022143	PGDB_AS000017	View
% Inhibition	-	=	80-100	%	500 nM	-	-	-	MV-4-11	CN119654316A	PGDB_A084491	PGDB_C022143	PGDB_AS001323	View
% Inhibition	-	=	0-5	%	10 nM	96 h	-	-	MOLT-4	CN119654316A	PGDB_A084825	PGDB_C022143	PGDB_AS002038	View
% Inhibition	-	=	50-60	%	500 nM	-	-	-	MM.1S	CN119654316A	PGDB_A084940	PGDB_C022143	PGDB_AS000639	View
% Degradation	-	=	80-100	%	-	-	-	-	-	CN119654316A	PGDB_A085536	PGDB_C022143	PGDB_AS000466	View
% Inhibition	-	=	18-25	%	10 nM	-	-	-	MV-4-11	CN119654316A	PGDB_A085589	PGDB_C022143	PGDB_AS000053	View

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