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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Anandamide amidohydrolase' and Ligand = 'BDBM50185014'   
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))
BDBM50185014
PNG
((Z)-N-{(1S)-3-chloro-1-[(4-hydroxyphenyl)methyl]pr...)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)CCl
Show InChI InChI=1S/C28H44ClNO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-28(33)30-26(27(32)23-29)22-24-18-20-25(31)21-19-24/h9-10,18-21,26,31H,2-8,11-17,22-23H2,1H3,(H,30,33)/b10-9-/t26-/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))
BDBM50185014
PNG
((Z)-N-{(1S)-3-chloro-1-[(4-hydroxyphenyl)methyl]pr...)
Show SMILES CCCCCCCC\C=C/CCCCCCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)CCl
Show InChI InChI=1S/C28H44ClNO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-28(33)30-26(27(32)23-29)22-24-18-20-25(31)21-19-24/h9-10,18-21,26,31H,2-8,11-17,22-23H2,1H3,(H,30,33)/b10-9-/t26-/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