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BDBM50222960 CHEMBL27444

SMILES: CC1CCN(CCCOc2ccc(cc2)-c2ccc(cc2)C(=O)N2CCCC2)CC1

InChI Key: InChIKey=ONGDGNSWVOSLPV-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 = 50222960   
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))
BDBM50222960
PNG
(CHEMBL27444)
Show SMILES CC1CCN(CCCOc2ccc(cc2)-c2ccc(cc2)C(=O)N2CCCC2)CC1
Show InChI InChI=1S/C26H34N2O2/c1-21-13-18-27(19-14-21)15-4-20-30-25-11-9-23(10-12-25)22-5-7-24(8-6-22)26(29)28-16-2-3-17-28/h5-12,21H,2-4,13-20H2,1H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
3.60n/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))
BDBM50222960
PNG
(CHEMBL27444)
Show SMILES CC1CCN(CCCOc2ccc(cc2)-c2ccc(cc2)C(=O)N2CCCC2)CC1
Show InChI InChI=1S/C26H34N2O2/c1-21-13-18-27(19-14-21)15-4-20-30-25-11-9-23(10-12-25)22-5-7-24(8-6-22)26(29)28-16-2-3-17-28/h5-12,21H,2-4,13-20H2,1H3
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
10n/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