PatGlueDB | Molecular Glue Patent Bioactivity Database

2D structure

O=C1CCC(N2Cc3cc(CN4CCN(c5c[nH]c6ncccc56)CC4)ccc3C2=S)C(=O)N1

Compound summary

Compound IDPGDB_C022294

FormulaC25H26N6O2S

Molecular weight474.59

InChIKeyVRLNAJIVDUTVCI-UHFFFAOYSA-N

Physicochemical properties

Exact mass474.1838

RDKit cLogP2.18

TPSA84.6

HBD / HBA2 / 6

Rotatable bonds4

Heavy atoms34

Hetero atoms9

Rings / aromatic6 / 3

Fraction Csp30.36

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_A082030	PGDB_C022294	PGDB_AS000042	View
% Inhibition	-	=	40-53	%	0.5 uM	3 h	CRBN	CRBN	-	CN119654316A	PGDB_A082387	PGDB_C022294	PGDB_AS001405	View
% Inhibition	-	=	40-60	%	500 nM	-	-	-	MV-4-11	CN119654316A	PGDB_A082518	PGDB_C022294	PGDB_AS001323	View
% Inhibition	-	=	60-80	%	2 uM	3 h	CRBN	CRBN	-	CN119654316A	PGDB_A083209	PGDB_C022294	PGDB_AS002552	View
% Degradation	-	=	80-100	%	-	-	IKZF3	-	-	CN119654316A	PGDB_A083597	PGDB_C022294	PGDB_AS000017	View
% Degradation	-	=	80-100	%	-	-	-	-	-	CN119654316A	PGDB_A083617	PGDB_C022294	PGDB_AS000466	View
% Degradation	-	=	80-100	%	-	-	WEE1	-	-	CN119654316A	PGDB_A084032	PGDB_C022294	PGDB_AS001023	View
% Degradation	-	=	80-100	%	-	-	IKZF2	-	-	CN119654316A	PGDB_A084287	PGDB_C022294	PGDB_AS002430	View
% Degradation	-	=	80-100	%	-	-	IKZF1	-	-	CN119654316A	PGDB_A084371	PGDB_C022294	PGDB_AS001680	View
% Inhibition	-	=	40-50	%	500 nM	-	-	-	MM.1S	CN119654316A	PGDB_A085052	PGDB_C022294	PGDB_AS000639	View
% Degradation	-	=	0-80	%	-	-	GSPT1	-	-	CN119654316A	PGDB_A085379	PGDB_C022294	PGDB_AS000660	View
% Inhibition	-	=	40-60	%	10 nM	-	-	-	MV-4-11	CN119654316A	PGDB_A085591	PGDB_C022294	PGDB_AS000053	View

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