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SMILES: CCCCCCCCCCCCCC(=O)Nc1ccc(CC(=O)NO)cc1

InChI Key: InChIKey=YYNXXUPRLFHVIX-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50264200   
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
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Mus musculus)
BDBM50264200
PNG
(CHEMBL4094307)
Show SMILES CCCCCCCCCCCCCC(=O)Nc1ccc(CC(=O)NO)cc1
Show InChI InChI=1S/C22H36N2O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-21(25)23-20-16-14-19(15-17-20)18-22(26)24-27/h14-17,27H,2-13,18H2,1H3,(H,23,25)(H,24,26)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.00E+3n/an/an/an/an/an/a



National and Kapodistrian University of Athens

Curated by ChEMBL


Assay Description
Inhibition of mouse ATX-beta using LPC 16:0 as substrate by Amplex Red PLD assay


J Med Chem 61: 3697-3711 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00232
BindingDB Entry DOI: 10.7270/Q2Q52S3G
More data for this
Ligand-Target Pair
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2


(Mus musculus)
BDBM50264200
PNG
(CHEMBL4094307)
Show SMILES CCCCCCCCCCCCCC(=O)Nc1ccc(CC(=O)NO)cc1
Show InChI InChI=1S/C22H36N2O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-21(25)23-20-16-14-19(15-17-20)18-22(26)24-27/h14-17,27H,2-13,18H2,1H3,(H,23,25)(H,24,26)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 200n/an/an/an/an/an/a



National and Kapodistrian University of Athens

Curated by ChEMBL


Assay Description
Inhibition of mouse ATX-beta using LPC 18:0 as substrate by Amplex Red PLD assay


J Med Chem 61: 3697-3711 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00232
BindingDB Entry DOI: 10.7270/Q2Q52S3G
More data for this
Ligand-Target Pair