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BDBM50327872 (1-Butylpiperidin-4-yl)methyl 4-Amino-2-methoxybenzoate::CHEMBL1258451

SMILES: CCCCN1CCC(COC(=O)c2ccc(N)cc2OC)CC1

InChI Key: InChIKey=OTXPJGFSRLEQNE-UHFFFAOYSA-N

Data: 1 KI  1 EC50

Find this compound or compounds like it in BindingDB or PDB:
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50327872   
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
5-hydroxytryptamine receptor 4 (5-HT4)


(Homo sapiens (Human))
BDBM50327872
PNG
((1-Butylpiperidin-4-yl)methyl 4-Amino-2-methoxyben...)
Show SMILES CCCCN1CCC(COC(=O)c2ccc(N)cc2OC)CC1
Show InChI InChI=1S/C18H28N2O3/c1-3-4-9-20-10-7-14(8-11-20)13-23-18(21)16-6-5-15(19)12-17(16)22-2/h5-6,12,14H,3-4,7-11,13,19H2,1-2H3
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
50n/an/an/an/an/an/an/an/a



National Institute of Mental Health

Curated by ChEMBL


Assay Description
Displacement of [3H]GR113808 from human recombinant 5HT4 receptor expressed in HEK293 cells


J Med Chem 53: 7035-47 (2010)

More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4 (5-HT4)


(Homo sapiens (Human))
BDBM50327872
PNG
((1-Butylpiperidin-4-yl)methyl 4-Amino-2-methoxyben...)
Show SMILES CCCCN1CCC(COC(=O)c2ccc(N)cc2OC)CC1
Show InChI InChI=1S/C18H28N2O3/c1-3-4-9-20-10-7-14(8-11-20)13-23-18(21)16-6-5-15(19)12-17(16)22-2/h5-6,12,14H,3-4,7-11,13,19H2,1-2H3
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 0.178n/an/an/an/a



National Institute of Mental Health

Curated by ChEMBL


Assay Description
Agonist activity at 5HT4 receptor expressed in HEK293/L9 cells by cAMP assay


J Med Chem 53: 7035-47 (2010)

More data for this
Ligand-Target Pair