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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 = 'BDBM50216683'   
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))
BDBM50216683
PNG
(1-(5-iodonaphthalen-1-ylsulfonyl)-1,4-diazepane | ...)
Show SMILES Ic1cccc2c(cccc12)S(=O)(=O)N1CCCNCC1
Show InChI InChI=1S/C15H17IN2O2S/c16-14-6-1-5-13-12(14)4-2-7-15(13)21(19,20)18-10-3-8-17-9-11-18/h1-2,4-7,17H,3,8-11H2
PDB
MMDB

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Article
PubMed
n/an/a 3.80E+4n/an/an/an/an/an/a



Kalypsys, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ROCK1 assessed as ATP cunsumption


Bioorg Med Chem Lett 20: 3361-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.04.020
BindingDB Entry DOI: 10.7270/Q289161H
More data for this
Ligand-Target Pair