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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histamine H1 receptor' and Ligand = 'BDBM50516708'   
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
Histamine H1 receptor


(Homo sapiens (Human))		BDBM50516708
PNG
(CHEMBL4581343)
Show SMILES Clc1ccc2c(-[#6]-[#6]-c3cccnc3\[#6]-2=[#6]-2/[#6]-[#6]-[#7](-[#6]-[#6]-2)-[#6]-2-[#6]-[#6]-[#6]-2)c1
Show InChI InChI=1S/C23H25ClN2/c24-19-8-9-21-18(15-19)7-6-17-3-2-12-25-23(17)22(21)16-10-13-26(14-11-16)20-4-1-5-20/h2-3,8-9,12,15,20H,1,4-7,10-11,13-14H2
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PC cid
PC sid
UniChem
Article
PubMed
 2.10n/an/an/an/an/an/an/an/a



VU University Amsterdam

Curated by ChEMBL


Assay Description
Displacement of [3H]mepyramine from N-terminal HA-tagged H1R (unknown origin) expressed in HEK293T cells measured after 4 hrs by microbeta scintillat...

J Med Chem 62: 6630-6644 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00447
BindingDB Entry DOI: 10.7270/Q2HH6PFT
More data for this
Ligand-Target Pair