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BDBM50410340 CHEMBL195099

SMILES: CC(C)N1CCC(CC1)Oc1ccc(CN2CCC(Cc3ccccc3)CC2)cc1

InChI Key: InChIKey=HSPXTGVDUCGMMK-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 = 50410340   
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))
BDBM50410340
PNG
(CHEMBL195099)
Show SMILES CC(C)N1CCC(CC1)Oc1ccc(CN2CCC(Cc3ccccc3)CC2)cc1
Show InChI InChI=1S/C27H38N2O/c1-22(2)29-18-14-27(15-19-29)30-26-10-8-25(9-11-26)21-28-16-12-24(13-17-28)20-23-6-4-3-5-7-23/h3-11,22,24,27H,12-21H2,1-2H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.45n/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))
BDBM50410340
PNG
(CHEMBL195099)
Show SMILES CC(C)N1CCC(CC1)Oc1ccc(CN2CCC(Cc3ccccc3)CC2)cc1
Show InChI InChI=1S/C27H38N2O/c1-22(2)29-18-14-27(15-19-29)30-26-10-8-25(9-11-26)21-28-16-12-24(13-17-28)20-23-6-4-3-5-7-23/h3-11,22,24,27H,12-21H2,1-2H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 0.813n/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