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PubMed code 32249114

Compile data set for download or QSAR
Found 3 hits of Enzyme Inhibition Constant Data   
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 H3 receptor


(Homo sapiens (Human))
BDBM50542394
PNG
(CHEMBL4645505)
Show SMILES O=C(c1ccccc1)c1cccc(OCCCCCCN2CCCCCC2)c1
Show InChI InChI=1S/C25H33NO2/c27-25(22-13-6-5-7-14-22)23-15-12-16-24(21-23)28-20-11-4-3-10-19-26-17-8-1-2-9-18-26/h5-7,12-16,21H,1-4,8-11,17-20H2
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PC cid
PC sid
UniChem
Article
PubMed
41n/an/an/an/an/an/an/an/a



Jagiellonian University Medical College

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant full length H3R expressed in HEK293 cell membranes by Microbeta scintillation cou...


Bioorg Med Chem Lett 30: (2020)


Article DOI: 10.1016/j.bmcl.2020.127147
BindingDB Entry DOI: 10.7270/Q2F47SP5
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50542393
PNG
(CHEMBL4649808)
Show SMILES Fc1ccc(OCCCCCCN2CCCCCC2)cc1
Show InChI InChI=1S/C18H28FNO/c19-17-9-11-18(12-10-17)21-16-8-4-3-7-15-20-13-5-1-2-6-14-20/h9-12H,1-8,13-16H2
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137n/an/an/an/an/an/an/an/a



Jagiellonian University Medical College

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human recombinant full length H3R expressed in HEK293 cell membranes by Microbeta scintillation cou...


Bioorg Med Chem Lett 30: (2020)


Article DOI: 10.1016/j.bmcl.2020.127147
BindingDB Entry DOI: 10.7270/Q2F47SP5
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50542395
PNG
(CHEMBL4636354)
Show SMILES CC(C)(C)c1ccc(OCCCCCCN2CCCCCC2)cc1
Show InChI InChI=1S/C22H37NO/c1-22(2,3)20-12-14-21(15-13-20)24-19-11-7-6-10-18-23-16-8-4-5-9-17-23/h12-15H,4-11,16-19H2,1-3H3
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829n/an/an/an/an/an/an/an/a



Jagiellonian University Medical College

Curated by ChEMBL


Assay Description
Binding affinity to H3R (unknown origin)


Bioorg Med Chem Lett 30: (2020)


Article DOI: 10.1016/j.bmcl.2020.127147
BindingDB Entry DOI: 10.7270/Q2F47SP5
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%