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BDBM51138 (5Z)-5-[(1-methyl-3-indolyl)methylidene]-4-sulfanylidene-2-thiazolidinone::(5Z)-5-[(1-methylindol-3-yl)methylene]-4-thioxo-thiazolidin-2-one::(5Z)-5-[(1-methylindol-3-yl)methylidene]-4-sulfanylidene-1,3-thiazolidin-2-one::5-[(1-methyl-1H-indol-3-yl)methylene]-4-thioxo-1,3-thiazolidin-2-one::MLS000698017::SMR000225303::cid_1236521

SMILES: Cn1cc(C=C2SC(O)=NC2=S)c2ccccc12

InChI Key: InChIKey=MHNWGCUMEYITOR-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 51138   
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
Tyrosyl-DNA phosphodiesterase 1 (TDP1)


(Homo sapiens (Human))
BDBM51138
PNG
((5Z)-5-[(1-methyl-3-indolyl)methylidene]-4-sulfany...)
Show SMILES Cn1cc(C=C2SC(O)=NC2=S)c2ccccc12 |w:4.3,c:8|
Show InChI InChI=1S/C13H10N2OS2/c1-15-7-8(9-4-2-3-5-10(9)15)6-11-12(17)14-13(16)18-11/h2-7H,1H3,(H,14,16,17)
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 4.00E+4n/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Inhibition of human recombinant Tdp1 assessed as conversion of 14-mer 5'-32P-labeled 3'-phosphotyrosyl DNA substrate N14Y to 14-mer 5'-32P-labeled 3'...


J Med Chem 55: 8671-84 (2012)


Article DOI: 10.1021/jm3008773
BindingDB Entry DOI: 10.7270/Q2MP54D1
More data for this
Ligand-Target Pair
BZLF2


(Human herpesvirus 4 type 2)
BDBM51138
PNG
((5Z)-5-[(1-methyl-3-indolyl)methylidene]-4-sulfany...)
Show SMILES Cn1cc(C=C2SC(O)=NC2=S)c2ccccc12 |w:4.3,c:8|
Show InChI InChI=1S/C13H10N2OS2/c1-15-7-8(9-4-2-3-5-10(9)15)6-11-12(17)14-13(16)18-11/h2-7H,1H3,(H,14,16,17)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 3.07E+3n/an/an/an/an/an/a



Emory University Molecular Libraries Screening Center

Curated by PubChem BioAssay


Assay Description
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Theodore Jardetzky; Northw...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2057DCW
More data for this
Ligand-Target Pair