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BDBM50410326 CHEMBL194541

SMILES: CC(C)N1CCC(CC1)Oc1ccc(CN2CCC(CO)CC2)cc1

InChI Key: InChIKey=QBIIEUXFZBWGFA-UHFFFAOYSA-N

Data: 1 KI  1 Kd

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 = 50410326   
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))
BDBM50410326
PNG
(CHEMBL194541)
Show SMILES CC(C)N1CCC(CC1)Oc1ccc(CN2CCC(CO)CC2)cc1
Show InChI InChI=1S/C21H34N2O2/c1-17(2)23-13-9-21(10-14-23)25-20-5-3-18(4-6-20)15-22-11-7-19(16-24)8-12-22/h3-6,17,19,21,24H,7-16H2,1-2H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1n/an/an/an/an/an/an/an/a



Johnson& Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Mean binding affinity for human H3 receptor


J Med Chem 48: 2229-38 (2005)


Article DOI: 10.1021/jm049212n
BindingDB Entry DOI: 10.7270/Q2GB258T
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50410326
PNG
(CHEMBL194541)
Show SMILES CC(C)N1CCC(CC1)Oc1ccc(CN2CCC(CO)CC2)cc1
Show InChI InChI=1S/C21H34N2O2/c1-17(2)23-13-9-21(10-14-23)25-20-5-3-18(4-6-20)15-22-11-7-19(16-24)8-12-22/h3-6,17,19,21,24H,7-16H2,1-2H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 0.257n/an/an/an/an/a



Johnson& Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Mean functional activity against human H3 receptor


J Med Chem 48: 2229-38 (2005)


Article DOI: 10.1021/jm049212n
BindingDB Entry DOI: 10.7270/Q2GB258T
More data for this
Ligand-Target Pair