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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Rho-associated protein kinase 2' and Ligand = 'BDBM50382692'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Rho-associated protein kinase 2


(Homo sapiens (Human))
BDBM50382692
PNG
(CHEMBL2023150)
Show SMILES OC[C@H](Cc1ccccc1)NC(=O)Nc1ccc2[nH]ncc2c1 |r|
Show InChI InChI=1S/C17H18N4O2/c22-11-15(8-12-4-2-1-3-5-12)20-17(23)19-14-6-7-16-13(9-14)10-18-21-16/h1-7,9-10,15,22H,8,11H2,(H,18,21)(H2,19,20,23)/t15-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.30E+3n/an/an/an/an/an/a



H. Lee Moffitt Cancer Center and Research Institute

Curated by ChEMBL


Assay Description
Inhibition of ROCK2 after 1 hr by FRET-based enzyme-coupled assay


J Med Chem 55: 2474-8 (2012)


Article DOI: 10.1021/jm201289r
BindingDB Entry DOI: 10.7270/Q2MG7QH3
More data for this
Ligand-Target Pair