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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Anandamide amidohydrolase' and Ligand = 'BDBM50185011'   
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
Anandamide amidohydrolase


(Rattus norvegicus (rat))
BDBM50185011
PNG
((Z)-N-[(1S)-2-hydroxy-1-[(4-hydroxyphenyl)methyl]e...)
Show SMILES OC[C@H](Cc1ccc(O)cc1)NC(=O)CCCCCCC\C=C/CCOC(=O)c1ccccc1
Show InChI InChI=1S/C28H37NO5/c30-22-25(21-23-16-18-26(31)19-17-23)29-27(32)15-11-6-4-2-1-3-5-7-12-20-34-28(33)24-13-9-8-10-14-24/h5,7-10,13-14,16-19,25,30-31H,1-4,6,11-12,15,20-22H2,(H,29,32)/b7-5-/t25-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>5.00E+4n/an/an/an/an/an/a



Institute of Biomolecular Chemistry

Curated by ChEMBL


Assay Description
Inhibition of [14C]anandamide hydrolysis in rat brain membrane in the absence of UV irradiation


J Med Chem 49: 2320-32 (2006)


Article DOI: 10.1021/jm051226l
BindingDB Entry DOI: 10.7270/Q2CZ36R5
More data for this
Ligand-Target Pair
Anandamide amidohydrolase


(Rattus norvegicus (rat))
BDBM50185011
PNG
((Z)-N-[(1S)-2-hydroxy-1-[(4-hydroxyphenyl)methyl]e...)
Show SMILES OC[C@H](Cc1ccc(O)cc1)NC(=O)CCCCCCC\C=C/CCOC(=O)c1ccccc1
Show InChI InChI=1S/C28H37NO5/c30-22-25(21-23-16-18-26(31)19-17-23)29-27(32)15-11-6-4-2-1-3-5-7-12-20-34-28(33)24-13-9-8-10-14-24/h5,7-10,13-14,16-19,25,30-31H,1-4,6,11-12,15,20-22H2,(H,29,32)/b7-5-/t25-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>5.00E+4n/an/an/an/an/an/a



Institute of Biomolecular Chemistry

Curated by ChEMBL


Assay Description
Inhibition of [14C]anandamide hydrolysis in rat brain membrane in the presence of UV irradiation


J Med Chem 49: 2320-32 (2006)


Article DOI: 10.1021/jm051226l
BindingDB Entry DOI: 10.7270/Q2CZ36R5
More data for this
Ligand-Target Pair