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BDBM43280 2-[2-[2-(4-chloranyl-3-methyl-phenoxy)ethylsulfanyl]benzimidazol-1-yl]ethanoic acid::2-[2-[2-(4-chloro-3-methyl-phenoxy)ethylthio]benzimidazol-1-yl]acetic acid::2-[2-[2-(4-chloro-3-methylphenoxy)ethylsulfanyl]benzimidazol-1-yl]acetic acid::2-[2-[2-(4-chloro-3-methylphenoxy)ethylthio]-1-benzimidazolyl]acetic acid::UNM000011080601::cid_17027916

SMILES: Cc1cc(OCCSc2nc3ccccc3n2CC(O)=O)ccc1Cl

InChI Key: InChIKey=FGSWMMRHNQEBQB-UHFFFAOYSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 43280   
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
Ras-related C3 botulinum toxin substrate 1


(Mus musculus)
BDBM43280
PNG
(2-[2-[2-(4-chloranyl-3-methyl-phenoxy)ethylsulfany...)
Show SMILES Cc1cc(OCCSc2nc3ccccc3n2CC(O)=O)ccc1Cl
Show InChI InChI=1S/C18H17ClN2O3S/c1-12-10-13(6-7-14(12)19)24-8-9-25-18-20-15-4-2-3-5-16(15)21(18)11-17(22)23/h2-7,10H,8-9,11H2,1H3,(H,22,23)
PDB
MMDB

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PC cid
PC sid
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Similars

PCBioAssay
n/an/an/an/a 2.51E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2PC30S2
More data for this
Ligand-Target Pair