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BDBM50352088 CHEMBL1824243

SMILES: OC1CCN(CC1)[C@H]1CC[C@@H](CC1)c1ccc(OCCCN2CCCCC2)cc1

InChI Key: InChIKey=UMGZDRCZPRURFJ-AFARHQOCSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50352088   
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))		BDBM50352088
PNG
(CHEMBL1824243)
Show SMILES OC1CCN(CC1)[C@H]1CC[C@@H](CC1)c1ccc(OCCCN2CCCCC2)cc1 |r,wU:7.7,wD:10.14,(38.79,-26.58,;37.25,-26.57,;36.46,-27.89,;34.93,-27.87,;34.18,-26.53,;34.95,-25.2,;36.5,-25.22,;32.64,-26.51,;31.85,-27.84,;30.32,-27.83,;29.56,-26.49,;30.33,-25.16,;31.88,-25.17,;28.02,-26.47,;27.24,-27.8,;25.71,-27.8,;24.94,-26.45,;23.4,-26.45,;22.63,-27.78,;21.09,-27.78,;20.33,-26.45,;18.79,-26.44,;18.02,-27.77,;16.48,-27.77,;15.71,-26.44,;16.48,-25.11,;18.02,-25.11,;25.71,-25.13,;27.25,-25.14,)|
Show InChI InChI=1S/C25H40N2O2/c28-24-13-18-27(19-14-24)23-9-5-21(6-10-23)22-7-11-25(12-8-22)29-20-4-17-26-15-2-1-3-16-26/h7-8,11-12,21,23-24,28H,1-6,9-10,13-20H2/t21-,23-
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Similars
Article
PubMed
 0.570n/an/an/an/an/an/an/an/a



Bioprojet-Biotech

Curated by ChEMBL


Assay Description
Displacement of [125I]Iodoproxyfan from recombinant human histamine H3 receptor expressed in HEK293 cells after 60 mins

Bioorg Med Chem Lett 21: 5384-8 (2011)


Article DOI: 10.1016/j.bmcl.2011.06.102
BindingDB Entry DOI: 10.7270/Q2DV1K7H
More data for this
Ligand-Target Pair