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BDBM50415668 CHEMBL1078491

SMILES: CN1CCOc2cc(ccc12)S(=O)(=O)Nc1ccc2CCN(Cc3ccn[nH]3)CCc2c1

InChI Key: InChIKey=ZYVXMBZAPDQCJH-UHFFFAOYSA-N

Data: 2 EC50

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 = 50415668   
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
Motilin receptor


(Homo sapiens (Human))
BDBM50415668
PNG
(CHEMBL1078491)
Show SMILES CN1CCOc2cc(ccc12)S(=O)(=O)Nc1ccc2CCN(Cc3ccn[nH]3)CCc2c1
Show InChI InChI=1S/C23H27N5O3S/c1-27-12-13-31-23-15-21(4-5-22(23)27)32(29,30)26-19-3-2-17-7-10-28(11-8-18(17)14-19)16-20-6-9-24-25-20/h2-6,9,14-15,26H,7-8,10-13,16H2,1H3,(H,24,25)
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KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
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AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 31.6n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


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


Bioorg Med Chem Lett 19: 6452-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.027
BindingDB Entry DOI: 10.7270/Q2DV1K0C
More data for this
Ligand-Target Pair
Ghrelin receptor


(Homo sapiens (Human))
BDBM50415668
PNG
(CHEMBL1078491)
Show SMILES CN1CCOc2cc(ccc12)S(=O)(=O)Nc1ccc2CCN(Cc3ccn[nH]3)CCc2c1
Show InChI InChI=1S/C23H27N5O3S/c1-27-12-13-31-23-15-21(4-5-22(23)27)32(29,30)26-19-3-2-17-7-10-28(11-8-18(17)14-19)16-20-6-9-24-25-20/h2-6,9,14-15,26H,7-8,10-13,16H2,1H3,(H,24,25)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a>1.00E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human gherlin receptor


Bioorg Med Chem Lett 19: 6452-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.027
BindingDB Entry DOI: 10.7270/Q2DV1K0C
More data for this
Ligand-Target Pair