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SMILES: OC(=O)C(O)=O.CCC(C)(C)c1ccc(OCCCCCCCCN2CCCC(C)C2)cc1

InChI Key: InChIKey=OYQSKKDBTRKXGY-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50459830   
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
Histamine H3 receptor


(Homo sapiens (Human))		BDBM50459830
PNG
(CHEMBL4228257)
Show SMILES OC(=O)C(O)=O.CCC(C)(C)c1ccc(OCCCCCCCCN2CCCC(C)C2)cc1
Show InChI InChI=1S/C25H43NO.C2H2O4/c1-5-25(3,4)23-14-16-24(17-15-23)27-20-11-9-7-6-8-10-18-26-19-12-13-22(2)21-26;3-1(4)2(5)6/h14-17,22H,5-13,18-21H2,1-4H3;(H,3,4)(H,5,6)
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 121n/an/an/an/an/an/an/an/a



Jagiellonian University Medical College

Curated by ChEMBL


Assay Description
Displacement of [125I]Iodoproxyfan from recombinant human histamine H3 receptor expressed in CHOK1 cell membranes after 90 mins

Bioorg Med Chem 25: 2701-2712 (2017)


Article DOI: 10.1016/j.bmc.2017.03.031
BindingDB Entry DOI: 10.7270/Q2833VPK
More data for this
Ligand-Target Pair