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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Rho-associated protein kinase 1' and Ligand = 'BDBM50417685'   
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 1


(Homo sapiens (Human))
BDBM50417685
PNG
(CHEMBL1643576)
Show SMILES CS(=O)(=O)N1CCC[C@@H](C1)Oc1ccc2c(N)nccc2c1 |r|
Show InChI InChI=1S/C15H19N3O3S/c1-22(19,20)18-8-2-3-13(10-18)21-12-4-5-14-11(9-12)6-7-17-15(14)16/h4-7,9,13H,2-3,8,10H2,1H3,(H2,16,17)/t13-/m0/s1
PDB
MMDB

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UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



MSD

Curated by ChEMBL


Assay Description
Inhibition of ROCK-1 by Immobilized metal ion affinity-based fluorescence polarization assay


Bioorg Med Chem Lett 21: 97-101 (2010)


Article DOI: 10.1016/j.bmcl.2010.11.060
BindingDB Entry DOI: 10.7270/Q29W0GQK
More data for this
Ligand-Target Pair