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BDBM61562 (5Z)-3-methyl-5-[(5-phenyl-1H-pyrazol-4-yl)methylene]-2-thioxo-thiazolidin-4-one::(5Z)-3-methyl-5-[(5-phenyl-1H-pyrazol-4-yl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one::(5Z)-3-methyl-5-[(5-phenyl-1H-pyrazol-4-yl)methylidene]-2-sulfanylidene-4-thiazolidinone::3-Methyl-5-[1-(3-phenyl-1H-pyrazol-4-yl)-meth-(Z)-ylidene]-2-thioxo-thiazolidin-4-one::MLS000769503::SMR000434236::cid_1981775

SMILES: CN1C(=S)SC(=Cc2c[nH]nc2-c2ccccc2)C1=O

InChI Key: InChIKey=XMLNZZPSRLRDKD-XFFZJAGNSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 61562   
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
G-protein coupled receptor 55


(Homo sapiens (Human))
BDBM61562
PNG
((5Z)-3-methyl-5-[(5-phenyl-1H-pyrazol-4-yl)methyle...)
Show SMILES CN1C(=S)SC(=Cc2c[nH]nc2-c2ccccc2)C1=O |w:6.6|
Show InChI InChI=1S/C14H11N3OS2/c1-17-13(18)11(20-14(17)19)7-10-8-15-16-12(10)9-5-3-2-4-6-9/h2-8H,1H3,(H,15,16)/b11-7-
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n/an/a 653n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2348HSG
More data for this
Ligand-Target Pair