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BDBM76193 (2Z)-2-[2-[2-(3-methoxy-3-oxidanylidene-propylidene)hydrazinyl]-4-oxidanylidene-1,3-thiazol-5-ylidene]ethanoic acid::(2Z)-2-[2-[2-(3-methoxy-3-oxopropylidene)hydrazinyl]-4-oxo-1,3-thiazol-5-ylidene]acetic acid::(2Z)-2-[2-[2-(3-methoxy-3-oxopropylidene)hydrazinyl]-4-oxo-5-thiazolylidene]acetic acid::(2Z)-2-[4-keto-2-[N'-(3-keto-3-methoxy-propylidene)hydrazino]-2-thiazolin-5-ylidene]acetic acid::3-({5-[1-Carboxy-meth-(Z)-ylidene]-4-oxo-4,5-dihydro-thiazol-2-yl}-hydrazono)-propionic acid methyl ester::MLS000777481::SMR000413875::cid_16682271

SMILES: COC(=O)CC=NNC1=NC(=O)C(S1)=CC(O)=O

InChI Key: InChIKey=CWZOQHRJEBPZED-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 76193   
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))
BDBM76193
PNG
((2Z)-2-[2-[2-(3-methoxy-3-oxidanylidene-propyliden...)
Show SMILES COC(=O)CC=NNC1=NC(=O)C(S1)=CC(O)=O |w:6.6,14.15,t:8|
Show InChI InChI=1S/C9H9N3O5S/c1-17-7(15)2-3-10-12-9-11-8(16)5(18-9)4-6(13)14/h3-4H,2H2,1H3,(H,13,14)(H,11,12,16)
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 1.74E+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, CA...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2X63KDM
More data for this
Ligand-Target Pair
Alpi


(Rattus norvegicus (Rat))
BDBM76193
PNG
((2Z)-2-[2-[2-(3-methoxy-3-oxidanylidene-propyliden...)
Show SMILES COC(=O)CC=NNC1=NC(=O)C(S1)=CC(O)=O |w:6.6,14.15,t:8|
Show InChI InChI=1S/C9H9N3O5S/c1-17-7(15)2-3-10-12-9-11-8(16)5(18-9)4-6(13)14/h3-4H,2H2,1H3,(H,13,14)(H,11,12,16)
PDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 3.68E+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
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens (Human))
BDBM76193
PNG
((2Z)-2-[2-[2-(3-methoxy-3-oxidanylidene-propyliden...)
Show SMILES COC(=O)CC=NNC1=NC(=O)C(S1)=CC(O)=O |w:6.6,14.15,t:8|
Show InChI InChI=1S/C9H9N3O5S/c1-17-7(15)2-3-10-12-9-11-8(16)5(18-9)4-6(13)14/h3-4H,2H2,1H3,(H,13,14)(H,11,12,16)
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
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, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2H130G1
More data for this
Ligand-Target Pair
Alkaline phosphatase placental-like


(Homo sapiens (Human))
BDBM76193
PNG
((2Z)-2-[2-[2-(3-methoxy-3-oxidanylidene-propyliden...)
Show SMILES COC(=O)CC=NNC1=NC(=O)C(S1)=CC(O)=O |w:6.6,14.15,t:8|
Show InChI InChI=1S/C9H9N3O5S/c1-17-7(15)2-3-10-12-9-11-8(16)5(18-9)4-6(13)14/h3-4H,2H2,1H3,(H,13,14)(H,11,12,16)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 8.44E+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/Q2NS0SCW
More data for this
Ligand-Target Pair