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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Fatty-acid amide hydrolase 1 [30-579]' and Ligand = 'BDBM10921'   
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
Fatty-acid amide hydrolase 1 [30-579]


(Rattus norvegicus (rat))
BDBM10921
PNG
(3-({methyl[3-({5-oxo-5H-chromeno[2,3-b]pyridin-8-y...)
Show SMILES CCCCNC(=O)Oc1cccc(CN(C)CCCOc2ccc3c(c2)oc2ncccc2c3=O)c1
Show InChI InChI=1S/C28H31N3O5/c1-3-4-13-30-28(33)35-22-9-5-8-20(17-22)19-31(2)15-7-16-34-21-11-12-23-25(18-21)36-27-24(26(23)32)10-6-14-29-27/h5-6,8-12,14,17-18H,3-4,7,13,15-16,19H2,1-2H3,(H,30,33)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.40E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of FAAH in rat brain membranes assessed as hydrolysis of [14C]-anandamide preincubated for 20 mins before [14C]-anandamide addition measur...


ACS Med Chem Lett 3: 182-186 (2012)


Article DOI: 10.1021/ml200313p
BindingDB Entry DOI: 10.7270/Q29W0GJB
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1 [30-579]


(Rattus norvegicus (rat))
BDBM10921
PNG
(3-({methyl[3-({5-oxo-5H-chromeno[2,3-b]pyridin-8-y...)
Show SMILES CCCCNC(=O)Oc1cccc(CN(C)CCCOc2ccc3c(c2)oc2ncccc2c3=O)c1
Show InChI InChI=1S/C28H31N3O5/c1-3-4-13-30-28(33)35-22-9-5-8-20(17-22)19-31(2)15-7-16-34-21-11-12-23-25(18-21)36-27-24(26(23)32)10-6-14-29-27/h5-6,8-12,14,17-18H,3-4,7,13,15-16,19H2,1-2H3,(H,30,33)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 4.23E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of FAAH in rat brain membranes assessed as hydrolysis of [14C]-anandamide after 30 mins


ACS Med Chem Lett 3: 182-186 (2012)


Article DOI: 10.1021/ml200313p
BindingDB Entry DOI: 10.7270/Q29W0GJB
More data for this
Ligand-Target Pair