Compound name
NVS-PAK1-1
Protein family
Protein Kinase
Target name
PAK1
Affinity biochemical (nM)
6
Affinity on-target cellular (nM)
250
CG-Set
Kinase set
Recommended Concentration
1 µM
Compound EUbOPEN ID
EUB0000164c
SMILES
CC(C)NC(=O)N1CC[C@H](NC2=Nc3cc(F)ccc3N(CC(F)F)c3ccc(Cl)cc32)C1
InChIKey
OINGHOPGNMYCAB-INIZCTEOSA-N
NCBI gene ID
5058
UniProt ID
Q13153
Mode of action
Allosteric inhibitor
Negative control
NVS-PAK1-C
Affinity biochemical definition
IC50
Affinity biochemical assay type
Caliper in vitro assay
Affinity Biochemical Source Knowledge
https://www.thesgc.org/chemical-probes/nvs-pak1-1
Affinity biochemical relation
=
Affinity on-target cellular definition
IC50
Affinity on-target cellular assay type
Western Blot (inhibition of autophosphorylation of PAK (S144) in Su86.86 cell line)
Affinity on-target cellular relation
=
Selectivity platform
KinomeScan (DiscoverX)
Selectivity platform number of targets
442
Selectivity remarks
Screened at 10 µM, S(10) = 0.003, closest target: IC50(PAK2) = 72 nM; Screened against 27 receptors (Novartis panel) at 10 µM, closest target: IC50(H1) = 13 µM, IC50(M1) = 13 µM; Screened against panel of 48 bromodomains at 10 µM in DSF-assay, all targets dTm < 1 K clean profile
Selectivity Source Knowledge
https://www.thesgc.org/chemical-probes/nvs-pak1-1
Selectivity Number of Off-targets
1