BindingDB logo
myBDB logout

BDBM50339880 3-(1-(4-(benzo[b]thiophen-2-yl)pyrimidin-2-yl)piperidin-3-yl)-1-methyl-1H-pyrrolo[2,3-b]pyridine::CHEMBL1761305

SMILES: Cn1cc(C2CCCN(C2)c2nccc(n2)-c2cc3ccccc3s2)c2cccnc12

InChI Key: InChIKey=DAMCTIRKMGYTMY-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50339880   
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
Fatty-acid amide hydrolase 1 (aa 30-579)


(Rattus norvegicus (rat))
BDBM50339880
PNG
(3-(1-(4-(benzo[b]thiophen-2-yl)pyrimidin-2-yl)pipe...)
Show SMILES Cn1cc(C2CCCN(C2)c2nccc(n2)-c2cc3ccccc3s2)c2cccnc12
Show InChI InChI=1S/C25H23N5S/c1-29-16-20(19-8-4-11-26-24(19)29)18-7-5-13-30(15-18)25-27-12-10-21(28-25)23-14-17-6-2-3-9-22(17)31-23/h2-4,6,8-12,14,16,18H,5,7,13,15H2,1H3
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 120n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of rat FAAH assessed as hydrolysis of anandamidoaminomethylcumarin


Bioorg Med Chem Lett 21: 2492-6 (2011)


Article DOI: 10.1016/j.bmcl.2011.02.052
BindingDB Entry DOI: 10.7270/Q2BG2P9M
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1


(Homo sapiens (Human))
BDBM50339880
PNG
(3-(1-(4-(benzo[b]thiophen-2-yl)pyrimidin-2-yl)pipe...)
Show SMILES Cn1cc(C2CCCN(C2)c2nccc(n2)-c2cc3ccccc3s2)c2cccnc12
Show InChI InChI=1S/C25H23N5S/c1-29-16-20(19-8-4-11-26-24(19)29)18-7-5-13-30(15-18)25-27-12-10-21(28-25)23-14-17-6-2-3-9-22(17)31-23/h2-4,6,8-12,14,16,18H,5,7,13,15H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 9n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of human FAAH assessed as hydrolysis of anandamidoaminomethylcumarin


Bioorg Med Chem Lett 21: 2492-6 (2011)


Article DOI: 10.1016/j.bmcl.2011.02.052
BindingDB Entry DOI: 10.7270/Q2BG2P9M
More data for this
Ligand-Target Pair