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BDBM76201 MLS001207297::N-[(5Z)-5-(3,4-dihydroxybenzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]benzamide::N-[(5Z)-5-[(3,4-dihydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide::N-[(5Z)-5-[(3,4-dihydroxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]benzamide::N-[(5Z)-5-[[3,4-bis(oxidanyl)phenyl]methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide::N-[5-(3,4-Dihydroxy-benzylidene)-4-oxo-2-thioxo-thiazolidin-3-yl]-benzamide::SMR000515623::cid_1725045

SMILES: Oc1ccc(\C=C2/SC(=S)N(NC(=O)c3ccccc3)C2=O)cc1O

InChI Key: InChIKey=GMRPUDKLBOTNPQ-ZROIWOOFSA-N

Data: 6 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 6 hits for monomerid = 76201   
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
Intestinal alkaline phosphatase


(Homo sapiens (Human))
BDBM76201
PNG
(MLS001207297 | N-[(5Z)-5-(3,4-dihydroxybenzylidene...)
Show SMILES Oc1ccc(\C=C2/SC(=S)N(NC(=O)c3ccccc3)C2=O)cc1O
Show InChI InChI=1S/C17H12N2O4S2/c20-12-7-6-10(8-13(12)21)9-14-16(23)19(17(24)25-14)18-15(22)11-4-2-1-3-5-11/h1-9,20-21H,(H,18,22)/b14-9-
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
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UniChem

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PCBioAssay
n/an/a>1.00E+5n/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, CA...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2X63KDM
More data for this
Ligand-Target Pair
Alkaline phosphatase placental-like


(Homo sapiens (Human))
BDBM76201
PNG
(MLS001207297 | N-[(5Z)-5-(3,4-dihydroxybenzylidene...)
Show SMILES Oc1ccc(\C=C2/SC(=S)N(NC(=O)c3ccccc3)C2=O)cc1O
Show InChI InChI=1S/C17H12N2O4S2/c20-12-7-6-10(8-13(12)21)9-14-16(23)19(17(24)25-14)18-15(22)11-4-2-1-3-5-11/h1-9,20-21H,(H,18,22)/b14-9-
PDB
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n/an/a>1.00E+5n/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/Q2NS0SCW
More data for this
Ligand-Target Pair
lens epithelium-derived growth factor p75


(Homo sapiens (Human))
BDBM76201
PNG
(MLS001207297 | N-[(5Z)-5-(3,4-dihydroxybenzylidene...)
Show SMILES Oc1ccc(\C=C2/SC(=S)N(NC(=O)c3ccccc3)C2=O)cc1O
Show InChI InChI=1S/C17H12N2O4S2/c20-12-7-6-10(8-13(12)21)9-14-16(23)19(17(24)25-14)18-15(22)11-4-2-1-3-5-11/h1-9,20-21H,(H,18,22)/b14-9-
PDB
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n/an/a 1.80E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: Ohio State University Assay Provider: Mam...


PubChem Bioassay (2014)


BindingDB Entry DOI: 10.7270/Q2KD1WKS
More data for this
Ligand-Target Pair
Alpi


(Rattus norvegicus (Rat))
BDBM76201
PNG
(MLS001207297 | N-[(5Z)-5-(3,4-dihydroxybenzylidene...)
Show SMILES Oc1ccc(\C=C2/SC(=S)N(NC(=O)c3ccccc3)C2=O)cc1O
Show InChI InChI=1S/C17H12N2O4S2/c20-12-7-6-10(8-13(12)21)9-14-16(23)19(17(24)25-14)18-15(22)11-4-2-1-3-5-11/h1-9,20-21H,(H,18,22)/b14-9-
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n/an/a 1.28E+3n/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/Q2DB809V
More data for this
Ligand-Target Pair
lens epithelium-derived growth factor p75


(Homo sapiens (Human))
BDBM76201
PNG
(MLS001207297 | N-[(5Z)-5-(3,4-dihydroxybenzylidene...)
Show SMILES Oc1ccc(\C=C2/SC(=S)N(NC(=O)c3ccccc3)C2=O)cc1O
Show InChI InChI=1S/C17H12N2O4S2/c20-12-7-6-10(8-13(12)21)9-14-16(23)19(17(24)25-14)18-15(22)11-4-2-1-3-5-11/h1-9,20-21H,(H,18,22)/b14-9-
PDB
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n/an/a 2.71E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: Ohio State University Assay Provider: Mam...


PubChem Bioassay (2014)


BindingDB Entry DOI: 10.7270/Q2Q52N9H
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens (Human))
BDBM76201
PNG
(MLS001207297 | N-[(5Z)-5-(3,4-dihydroxybenzylidene...)
Show SMILES Oc1ccc(\C=C2/SC(=S)N(NC(=O)c3ccccc3)C2=O)cc1O
Show InChI InChI=1S/C17H12N2O4S2/c20-12-7-6-10(8-13(12)21)9-14-16(23)19(17(24)25-14)18-15(22)11-4-2-1-3-5-11/h1-9,20-21H,(H,18,22)/b14-9-
KEGG

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n/an/a 2.00E+4n/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/Q2H130G1
More data for this
Ligand-Target Pair