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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Motilin receptor' and Ligand = 'BDBM50412521'   
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
Motilin receptor


(Homo sapiens (Human))
BDBM50412521
PNG
(CHEMBL465104)
Show SMILES COCCCN(Cc1ccccc1-c1ccc(CN2CCNCC2)cc1)C(=O)COc1ccccc1
Show InChI InChI=1S/C30H37N3O3/c1-35-21-7-18-33(30(34)24-36-28-9-3-2-4-10-28)23-27-8-5-6-11-29(27)26-14-12-25(13-15-26)22-32-19-16-31-17-20-32/h2-6,8-15,31H,7,16-24H2,1H3
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PC cid
PC sid
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Article
PubMed
n/an/an/an/a 398n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant motilin receptor expressed in HEK293 cells by FLIPR assay


Bioorg Med Chem Lett 18: 6429-36 (2008)


Article DOI: 10.1016/j.bmcl.2008.10.072
BindingDB Entry DOI: 10.7270/Q2HQ3ZR3
More data for this
Ligand-Target Pair
Motilin receptor


(Homo sapiens (Human))
BDBM50412521
PNG
(CHEMBL465104)
Show SMILES COCCCN(Cc1ccccc1-c1ccc(CN2CCNCC2)cc1)C(=O)COc1ccccc1
Show InChI InChI=1S/C30H37N3O3/c1-35-21-7-18-33(30(34)24-36-28-9-3-2-4-10-28)23-27-8-5-6-11-29(27)26-14-12-25(13-15-26)22-32-19-16-31-17-20-32/h2-6,8-15,31H,7,16-24H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 398n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant motilin receptor expressed in HEK293 cells by calcium mobilization-based FLIPR assay


Bioorg Med Chem Lett 18: 6423-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.10.071
BindingDB Entry DOI: 10.7270/Q2474C3P
More data for this
Ligand-Target Pair