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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 4' and Ligand = 'BDBM325602'   
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
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM325602
PNG
(1-Isopropyl-3-{5-[1-(tetrahydro-pyran-4-ylmethyl)-...)
Show SMILES CC(C)n1nc(-c2nnc(o2)C2CCN(CC3CCOCC3)CC2)c2ccccc12
Show InChI InChI=1S/C23H31N5O2/c1-16(2)28-20-6-4-3-5-19(20)21(26-28)23-25-24-22(30-23)18-7-11-27(12-8-18)15-17-9-13-29-14-10-17/h3-6,16-18H,7-15H2,1-2H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/an/an/a 84n/an/an/an/a


TBA

Assay Description
Antagonist potency against carbachol induced contractions of isolated guinea pig ileum Muscarinic acetylcholine receptor

Citation and Details
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 4


(Homo sapiens (Human))		BDBM325602
PNG
(1-Isopropyl-3-{5-[1-(tetrahydro-pyran-4-ylmethyl)-...)
Show SMILES CC(C)n1nc(-c2nnc(o2)C2CCN(CC3CCOCC3)CC2)c2ccccc12
Show InChI InChI=1S/C23H31N5O2/c1-16(2)28-20-6-4-3-5-19(20)21(26-28)23-25-24-22(30-23)18-7-11-27(12-8-18)15-17-9-13-29-14-10-17/h3-6,16-18H,7-15H2,1-2H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 84.5n/an/an/an/a



SUVEN LIFE SCIENCES LIMITED

US Patent


Assay Description
A stable CHO cell line expressing recombinant human 5-HT4 receptor and pCRE-Luc reporter system was used for cell-based assay. The assay offers a non...

US Patent US9636335 (2017)


BindingDB Entry DOI: 10.7270/Q2PG1TTQ
More data for this
Ligand-Target Pair