PatGlueDB | Molecular Glue Patent Bioactivity Database

2D structure

O=C1CCC(N2C(=O)c3ccc(CN4CCC(N5CCN(C(c6ccccc6)c6ccccc6)CC5)C(F)(F)C4)cc3C2=O)C(=O)N1

Compound summary

Compound IDPGDB_C000826

FormulaC36H37F2N5O4

Molecular weight641.719

InChIKeyRSRRUQIQHSKCEH-UHFFFAOYSA-N

Physicochemical properties

Exact mass641.2814

RDKit cLogP3.7

TPSA93.3

HBD / HBA1 / 7

Rotatable bonds7

Heavy atoms47

Hetero atoms11

Rings / aromatic7 / 3

Fraction Csp30.39

Formal charge0

Fragments1

Activity compounds and values

Activity records

12 records

	Control		Value		Concentration	Time					Record ID	Compound	Assay	Details
% Inhibition	-	=	50-60	%	1 uM	24 h	-	-	-	CN120548310A	PGDB_A017096	PGDB_C000826	PGDB_AS000125	View
% Inhibition	-	=	50-60	%	0.1 uM	24 h	-	-	-	CN120548310A	PGDB_A020899	PGDB_C000826	PGDB_AS000584	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	GSPT1	-	-	CN120548310A	PGDB_A021717	PGDB_C000826	PGDB_AS001466	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF2	-	-	CN120548310A	PGDB_A031576	PGDB_C000826	PGDB_AS002025	View
% Inhibition	-	=	20-30	%	1 uM	24 h	-	-	-	CN120548310A	PGDB_A041579	PGDB_C000826	PGDB_AS000157	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	CSNK1A1	-	-	CN120548310A	PGDB_A041749	PGDB_C000826	PGDB_AS001449	View
% Inhibition	-	=	40-50	%	1 uM	24 h	-	-	-	CN120548310A	PGDB_A042395	PGDB_C000826	PGDB_AS000296	View
% Degradation	-	=	0-20	%	Concentration series: 500 nM, 50 nM	24 h	WEE1	-	-	CN120548310A	PGDB_A052491	PGDB_C000826	PGDB_AS001655	View
% Degradation	-	=	0-20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF1	-	-	CN120548310A	PGDB_A060266	PGDB_C000826	PGDB_AS000946	View
% Inhibition	-	=	40-50	%	0.1 uM	24 h	-	-	-	CN120548310A	PGDB_A067893	PGDB_C000826	PGDB_AS001714	View
% Degradation	-	>=	20	%	Concentration series: 500 nM, 50 nM	24 h	IKZF3	-	-	CN120548310A	PGDB_A068508	PGDB_C000826	PGDB_AS000102	View
% Inhibition	-	=	40-50	%	0.1 uM	24 h	-	-	-	CN120548310A	PGDB_A071417	PGDB_C000826	PGDB_AS001320	View

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