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BDBM50456153 CHEMBL4213334

SMILES: COC(=O)N1CCC(CN2CCC(CNC(=O)c3cccn4cc(nc34)C(C)C)CC2)CC1

InChI Key: InChIKey=XYKRCTZIRYSQOK-UHFFFAOYSA-N

Data: 1 EC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50456153   
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
Serotonin (5-HT) receptor


(Homo sapiens (Human))		BDBM50456153
PNG
(CHEMBL4213334)
Show SMILES COC(=O)N1CCC(CN2CCC(CNC(=O)c3cccn4cc(nc34)C(C)C)CC2)CC1
Show InChI InChI=1S/C25H37N5O3/c1-18(2)22-17-30-10-4-5-21(23(30)27-22)24(31)26-15-19-6-11-28(12-7-19)16-20-8-13-29(14-9-20)25(32)33-3/h4-5,10,17-20H,6-9,11-16H2,1-3H3,(H,26,31)
UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 0.600n/an/an/an/a



Suven Life Sciences Limited

Curated by ChEMBL


Assay Description
Agonist activity at recombinant human 5-HT4E receptor expressed in CHO cells assessed as induction of c-AMP accumulation after 4 hrs by luciferase re...

J Med Chem 61: 4993-5008 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00457
BindingDB Entry DOI: 10.7270/Q21R6T32
More data for this
Ligand-Target Pair