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BDBM50222970 CHEMBL27115

SMILES: CC1CCN(CCCOc2ccc(cc2)-c2ccc(cc2)C(=O)N2CCC(C)CC2)CC1

InChI Key: InChIKey=QEYKZKCAWGQFFR-UHFFFAOYSA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50222970   
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))
BDBM50222970
PNG
(CHEMBL27115)
Show SMILES CC1CCN(CCCOc2ccc(cc2)-c2ccc(cc2)C(=O)N2CCC(C)CC2)CC1
Show InChI InChI=1S/C28H38N2O2/c1-22-12-17-29(18-13-22)16-3-21-32-27-10-8-25(9-11-27)24-4-6-26(7-5-24)28(31)30-19-14-23(2)15-20-30/h4-11,22-23H,3,12-21H2,1-2H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
11n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for human recombinant H3 receptor


Bioorg Med Chem Lett 13: 1325-8 (2003)


BindingDB Entry DOI: 10.7270/Q2HM59NM
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50222970
PNG
(CHEMBL27115)
Show SMILES CC1CCN(CCCOc2ccc(cc2)-c2ccc(cc2)C(=O)N2CCC(C)CC2)CC1
Show InChI InChI=1S/C28H38N2O2/c1-22-12-17-29(18-13-22)16-3-21-32-27-10-8-25(9-11-27)24-4-6-26(7-5-24)28(31)30-19-14-23(2)15-20-30/h4-11,22-23H,3,12-21H2,1-2H3
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
21n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards rat cortical H3 receptor


Bioorg Med Chem Lett 13: 1325-8 (2003)


BindingDB Entry DOI: 10.7270/Q2HM59NM
More data for this
Ligand-Target Pair