Compound name
BMS-345541 (ditrifluoroacetate)
Protein family
Protein Kinase
Target name
IKBKB
Affinity biochemical (nM)
130
CG-Set
Kinase set
Recommended Concentration
1 µM
Compound EUbOPEN ID
EUB0000589aTFA
SMILES
CC1=CN=C2N1C3=C(C=CC(C)=C3)N=C2NCCN.FC(F)(C(O)=O)F.FC(F)(C(O)=O)F
InChIKey
OWHLFAMVTWAXBL-UHFFFAOYSA-N
NCBI gene ID
3551
UniProt ID
O14920
Synonyms
IKK2, NFKBIKB, IKK-beta, IKKB
Mode of action
Allosteric inhibitor
Affinity biochemical definition
Kd
Affinity biochemical assay type
Competition binding assay
Affinity Biochemical Source Knowledge
https://doi.org/10.1038/nbt.1990
Affinity biochemical relation
=
Selectivity platform
Competition binding assay, literature
Selectivity platform number of targets
442
Selectivity remarks
In vitro follow up of closest targets: Kd(IKKB) = 170 nM, Kd(YSK4) = 200 nM, Kd(CDK11A) = 399 nM, Kd(CDK11B) = 420 nM, Kd(CDK13) = 800 nM, Kd(CDK7) = 680 nM, Kd(MYLK4) = 700 nM; S(300nM) = 0.0052, S(3µM) = 0.0440;
Selectivity Source Knowledge
https://doi.org/10.1038/nbt.1990
Selectivity Number of Off-targets
9