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SIMM · NJU
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SIMM · NJU
Compound
PGDB_C001324
10 activity records
2 related patents
2D structure
O=C1CCC(N2Cc3cc(C(=O)N4Cc5ccccc5C4)ccc3C2=O)C(=O)N1
Compound summary
Compound ID
PGDB_C001324
Formula
C22H19N3O4
Molecular weight
389.411
InChIKey
FIIAGEUEYRBNTL-UHFFFAOYSA-N
Physicochemical properties
Exact mass
389.1376
RDKit cLogP
1.6
TPSA
86.8
HBD / HBA
1 / 4
Rotatable bonds
2
Heavy atoms
29
Hetero atoms
7
Rings / aromatic
5 / 2
Fraction Csp3
0.27
Formal charge
0
Fragments
1
Activity compounds and values
Activity records
10 records
Structure
Metric
Control
Relation
Value
Unit
Concentration
Time
Target
E3
Cell line
Patent
Record ID
Compound
Assay
Details
% Degradation
-
=
90-100
%
10 uM
24 h
GSPT1
-
Jurkat
KR20250075510A
PGDB_A007973
PGDB_C001324
PGDB_AS001448
View
GI50
-
<=
0.1
uM
-
—
GSPT1
-
Jurkat
WO2025110699A1
PGDB_A019157
PGDB_C001324
PGDB_AS001887
View
% Degradation
-
=
90-100
%
1 uM
24 h
GSPT1
-
Jurkat
WO2025110699A1
PGDB_A021833
PGDB_C001324
PGDB_AS001008
View
% Degradation
-
=
90-100
%
0.1 uM
24 h
GSPT1
-
Jurkat
KR20250075510A
PGDB_A025304
PGDB_C001324
PGDB_AS002288
View
% Degradation
-
=
90-100
%
10 uM
24 h
GSPT1
-
Jurkat
WO2025110699A1
PGDB_A034295
PGDB_C001324
PGDB_AS001994
View
% Degradation
-
=
90-100
%
1 uM
24 h
GSPT1
-
Jurkat
KR20250075510A
PGDB_A037455
PGDB_C001324
PGDB_AS000601
View
GI50
-
<=
0.1
nM
-
—
GSPT1
-
Jurkat
KR20250075510A
PGDB_A039006
PGDB_C001324
PGDB_AS000013
View
Relative binding
Ctrl @ 5uM
<
0.1
%
5 uM
1 h
CRBN
CRBN
HEK293
WO2025110699A1
PGDB_A042536
PGDB_C001324
PGDB_AS001966
View
Relative binding
Ctrl @ 5uM
<
0.1
%
5 uM
1 h
CRBN
CRBN
HEK-293
KR20250075510A
PGDB_A074313
PGDB_C001324
PGDB_AS000026
View
% Degradation
-
=
90-100
%
0.1 uM
24 h
GSPT1
-
Jurkat
WO2025110699A1
PGDB_A076282
PGDB_C001324
PGDB_AS001067
View