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BDBM93743 3-[(4-chlorobenzyl)sulfanyl]-1-phenyl-1H-1,2,4-triazole::3-[(4-chlorobenzyl)thio]-1-phenyl-1,2,4-triazole::3-[(4-chlorophenyl)methylsulfanyl]-1-phenyl-1,2,4-triazole::3-[(4-chlorophenyl)methylthio]-1-phenyl-1,2,4-triazole::MLS000550104::SMR000115139::cid_1778827

InChI string: InChI=1S/C15H12ClN3S/c16-13-8-6-12(7-9-13)10-20-15-17-11-19(18-15)14-4-2-1-3-5-14/h1-9,11H,10H2

SMILES: Clc1ccc(CSc2ncn(n2)-c2ccccc2)cc1

InChI Key: InChIKey=OILZYNLAPXZVGP-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 93743   
Target
(Institution)
LigandTarget
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
Protein HSP-16.2


(Caenorhabditis elegans)
BDBM93743
PNG
(3-[(4-chlorobenzyl)sulfanyl]-1-phenyl-1H-1,2,4-tri...)
Show SMILES Clc1ccc(CSc2ncn(n2)-c2ccccc2)cc1
Show InChI InChI=1S/C15H12ClN3S/c16-13-8-6-12(7-9-13)10-20-15-17-11-19(18-15)14-4-2-1-3-5-14/h1-9,11H,10H2
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

AffyNet 
PCBioAssay
n/an/a 2.61E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay




PubChem Bioassay (2012)

More data for this
Ligand-Target Pair
SKiNhead family member (skn-1)


(Caenorhabditis elegans)
BDBM93743
PNG
(3-[(4-chlorobenzyl)sulfanyl]-1-phenyl-1H-1,2,4-tri...)
Show SMILES Clc1ccc(CSc2ncn(n2)-c2ccccc2)cc1
Show InChI InChI=1S/C15H12ClN3S/c16-13-8-6-12(7-9-13)10-20-15-17-11-19(18-15)14-4-2-1-3-5-14/h1-9,11H,10H2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

AffyNet 
PCBioAssay
n/an/a 1.12E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay




PubChem Bioassay (2012)

More data for this
Ligand-Target Pair