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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Alpha-enolase' and Ligand = 'BDBM50543109'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Alpha-enolase


(Homo sapiens (Human))
BDBM50543109
PNG
(CHEMBL4647387)
Show SMILES ON1CCCC(C1=O)P(O)(O)=O
Show InChI InChI=1S/C5H10NO5P/c7-5-4(12(9,10)11)2-1-3-6(5)8/h4,8H,1-3H2,(H2,9,10,11)
PDB

UniProtKB/SwissProt

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MCE
PC cid
PC sid
PDB
UniChem
Article
PubMed
n/an/a 5.90E+3n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c01039
BindingDB Entry DOI: 10.7270/Q2348QCK
More data for this
Ligand-Target Pair
Alpha-enolase


(Homo sapiens (Human))
BDBM50543109
PNG
(CHEMBL4647387)
Show SMILES ON1CCCC(C1=O)P(O)(O)=O
Show InChI InChI=1S/C5H10NO5P/c7-5-4(12(9,10)11)2-1-3-6(5)8/h4,8H,1-3H2,(H2,9,10,11)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

MCE
PC cid
PC sid
PDB
UniChem
Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



University of Texas MD Anderson Cancer Center

Curated by ChEMBL


Assay Description
Inhibition of ENO1 in overexpressed human D423 cells incubated for 5 days by crystal violet staining based spectrophotometry


ACS Med Chem Lett 11: 1484-1489 (2020)


Article DOI: 10.1021/acsmedchemlett.0c00203
BindingDB Entry DOI: 10.7270/Q2SB499G
More data for this
Ligand-Target Pair
Alpha-enolase


(Homo sapiens (Human))
BDBM50543109
PNG
(CHEMBL4647387)
Show SMILES ON1CCCC(C1=O)P(O)(O)=O
Show InChI InChI=1S/C5H10NO5P/c7-5-4(12(9,10)11)2-1-3-6(5)8/h4,8H,1-3H2,(H2,9,10,11)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

MCE
PC cid
PC sid
PDB
UniChem
Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



University of Texas MD Anderson Cancer Center

Curated by ChEMBL


Assay Description
Inhibition of ENO1 in wild-type human LN319 cells incubated for 5 days by crystal violet staining based spectrophotometry


ACS Med Chem Lett 11: 1484-1489 (2020)


Article DOI: 10.1021/acsmedchemlett.0c00203
BindingDB Entry DOI: 10.7270/Q2SB499G
More data for this
Ligand-Target Pair