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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 (ROCK I)' and Ligand = 'BDBM163433'   
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 (ROCK I)


(Rattus norvegicus (Rat))
BDBM163433
PNG
(BA-1049 | US9687483, 1)
Show SMILES C[C@@H](N)C1CCN(CC1)S(=O)(=O)c1cccc2cnccc12
Show InChI InChI=1S/C16H21N3O2S/c1-12(17)13-6-9-19(10-7-13)22(20,21)16-4-2-3-14-11-18-8-5-15(14)16/h2-5,8,11-13H,6-7,9-10,17H2,1H3/t12-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
Article
US Patent
n/an/a 2.10E+4n/an/an/an/an/a23



BIOAXONE BIOSCIENCES, INC.

US Patent


Assay Description
The inhibitor potency of BA-1049 (racemic mixture) and Fasudil (Calbiochem) were compared by fluorescent polarization assays performed using a Biomek...


US Patent US9687483 (2017)


Article DOI: 10.1021/jm021079g
BindingDB Entry DOI: 10.7270/Q2H993CZ
More data for this
Ligand-Target Pair