Reaction Details Report a problem with these data
Target
cAMP-dependent protein kinase catalytic subunit PRKX
Ligand
BDBM50462709
Substrate
n/a
Meas. Tech.
ChEMBL_1776403 (CHEMBL4233395)
IC50
>1000±n/a nM
Citation
 Gao, H; Marhefka, C; Jacobs, MD; Cao, J; Bandarage, UK; Green, J ROCK inhibitors 2. Improving potency, selectivity and solubility through the application of rationally designed solubilizing groups. Bioorg Med Chem Lett 28:2616-2621 (2018) [PubMed]  Article 
Target
Name:
cAMP-dependent protein kinase catalytic subunit PRKX
Synonyms:
PKX1 | PRKX | PRKX_HUMAN | Serine/threonine-protein kinase PRKX
Type:
Enzyme Catalytic Domain
Mol. Mass.:
40897.91
Organism:
Homo sapiens (Human)
Description:
gi_4826948
Residue:
358
Sequence:
MEAPGLAQAAAAESDSRKVAEETPDGAPALCPSPEALSPEPPVYSLQDFDTLATVGTGTFGRVHLVKEKTAKHFFALKVMSIPDVIRLKQEQHVHNEKSVLKEVSHPFLIRLFWTWHDERFLYMLMEYVPGGELFSYLRNRGRFSSTTGLFYSAEIICAIEYLHSKEIVYRDLKPENILLDRDGHIKLTDFGFAKKLVDRTWTLCGTPEYLAPEVIQSKGHGRAVDWWALGILIFEMLSGFPPFFDDNPFGIYQKILAGKIDFPRHLDFHVKDLIKKLLVVDRTRRLGNMKNGANDVKHHRWFRSVDWEAVPQRKLKPPIVPKIAGDGDTSNFETYPENDWDTAAPVPQKDLEIFKNF
  
Inhibitor
Name:
BDBM50462709
Synonyms:
CHEMBL4245507
Type:
Small organic molecule
Emp. Form.:
C23H27N5O2S
Mol. Mass.:
437.558
SMILES:
O=C(Cc1cccc(OCCCN2CCNCC2)c1)Nc1nc(cs1)-c1ccncc1
Structure:
Search PDB for entries with ligand similarity: