PatGlueDB | Molecular Glue Patent Bioactivity Database

2D structure

O=C1CCC(N2C(=O)c3cccc4c(Cc5ccc(CN6CCN(c7ccnc(-n8cnc(C(F)(F)F)c8)n7)CC6)cc5)ccc2c34)C(=O)N1

Compound summary

Compound IDPGDB_C025619

FormulaC36H31F3N8O3

Molecular weight680.691

InChIKeyHDAAFKBDUXDETD-UHFFFAOYSA-N

Physicochemical properties

Exact mass680.2471

RDKit cLogP4.51

TPSA116.6

HBD / HBA1 / 9

Rotatable bonds7

Heavy atoms50

Hetero atoms14

Rings / aromatic8 / 5

Fraction Csp30.28

Formal charge0

Fragments1

Activity compounds and values

Activity records

15 records

	Control		Value		Concentration	Time					Record ID	Compound	Assay	Details
Dmax	-	=	60	%	Concentration series: 1600 nM, 400 nM, 100 nM, 25 nM, 6.25 nM, 1.56 nM, 0.39 nM, 0.1 nM	24 h	-	-	NCI-H929	EP4685141A1	PGDB_A017131	PGDB_C025619	PGDB_AS000327	View
IC50	-	=	38	nM	-	—	CRBN	CRBN	-	CA3286762A1	PGDB_A019449	PGDB_C025619	PGDB_AS001113	View
IC50	-	=	38	nM	-	—	-	-	-	EP4685141A1	PGDB_A020352	PGDB_C025619	PGDB_AS001840	View
DC50	-	=	0.075	nM	-	—	IKZF3	-	NCI-H929	CA3286762A1	PGDB_A023982	PGDB_C025619	PGDB_AS000521	View
IC50	-	=	0.04	nM	-	—	-	-	NCI-H929	EP4685141A1	PGDB_A024836	PGDB_C025619	PGDB_AS001501	View
Dmax	-	=	76.2	%	Concentration series: 1600 nM, 400 nM, 100 nM, 25 nM, 6.25 nM, 1.56 nM, 0.39 nM, 0.1 nM	24 h	-	-	NCI-H929	EP4685141A1	PGDB_A026040	PGDB_C025619	PGDB_AS002256	View
Dmax	-	=	76.2	%	Concentration series: 1600 nM, 400 nM, 100 nM, 25 nM, 6.25 nM, 1.56 nM, 0.39 nM, 0.1 nM	24 h	IKZF3	-	NCI-H929	CA3286762A1	PGDB_A027390	PGDB_C025619	PGDB_AS001097	View
IC50	-	=	38	nM	-	—	-	-	-	EP4685141A1	PGDB_A032171	PGDB_C025619	PGDB_AS000581	View
DC50	-	=	0.075	nM	-	—	-	-	NCI-H929	EP4685141A1	PGDB_A039811	PGDB_C025619	PGDB_AS000575	View
DC50	-	=	0.98	nM	-	—	-	-	NCI-H929	EP4685141A1	PGDB_A040140	PGDB_C025619	PGDB_AS001024	View
Dmax	-	=	60	%	Concentration series: 1600 nM, 400 nM, 100 nM, 25 nM, 6.25 nM, 1.56 nM, 0.39 nM, 0.1 nM	24 h	IKZF1	-	NCI-H929	CA3286762A1	PGDB_A043944	PGDB_C025619	PGDB_AS000833	View
IC50	-	=	38	nM	-	—	-	-	-	EP4685141A1	PGDB_A045745	PGDB_C025619	PGDB_AS001083	View
DC50	-	=	0.98	nM	-	—	IKZF1	-	NCI-H929	CA3286762A1	PGDB_A067568	PGDB_C025619	PGDB_AS002338	View
IC50	-	=	38	nM	-	—	-	-	-	EP4685141A1	PGDB_A071505	PGDB_C025619	PGDB_AS001275	View
IC50	-	=	0.04	nM	-	—	-	-	NCI-H929	CA3286762A1	PGDB_A077160	PGDB_C025619	PGDB_AS001402	View

Rows per pagePage 1 of 1 · 15 recordsGo to page