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BDBM50436227 CHEMBL2398687

SMILES: CCN(CC)S(=O)(=O)c1cccc(c1)C(=O)N1CCCC(C1)C(=O)Nc1ccc(Cl)cc1

InChI Key: InChIKey=SBQLVGREKANOAN-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50436227   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Transforming protein RhoA


(Homo sapiens (Human))		BDBM50436227
PNG
(CHEMBL2398687)
Show SMILES CCN(CC)S(=O)(=O)c1cccc(c1)C(=O)N1CCCC(C1)C(=O)Nc1ccc(Cl)cc1
Show InChI InChI=1S/C23H28ClN3O4S/c1-3-27(4-2)32(30,31)21-9-5-7-17(15-21)23(29)26-14-6-8-18(16-26)22(28)25-20-12-10-19(24)11-13-20/h5,7,9-13,15,18H,3-4,6,8,14,16H2,1-2H3,(H,25,28)
PDB
MMDB

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 5.10E+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