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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Transforming protein RhoA' and Ligand = 'BDBM50436231'   
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
Transforming protein RhoA


(Homo sapiens (Human))		BDBM50436231
PNG
(CHEMBL2398683)
Show SMILES Cc1nc(cs1)-c1cccc(c1)C(=O)N1CCCC(C1)C(=O)Nc1ccc(Cl)cc1
Show InChI InChI=1S/C23H22ClN3O2S/c1-15-25-21(14-30-15)16-4-2-5-17(12-16)23(29)27-11-3-6-18(13-27)22(28)26-20-9-7-19(24)8-10-20/h2,4-5,7-10,12,14,18H,3,6,11,13H2,1H3,(H,26,28)
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PC cid
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Article
PubMed
n/an/a 3.30E+4n/an/an/an/an/an/a



College of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of RhoC-mediated pathway in human PC3 cells assessed as inhibition of SRE-regulated gene transcription by luciferase reporter gene assay

Bioorg Med Chem Lett 23: 3826-32 (2013)


Article DOI: 10.1016/j.bmcl.2013.04.080
BindingDB Entry DOI: 10.7270/Q28P61XS
More data for this
Ligand-Target Pair