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SMILES: COc1cn(ccc1=O)-c1ccc(OCCCN2CCCC2)cc1

InChI Key:

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 4 hits for monomerid = 50562729   
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))
BDBM50562729
PNG
(CHEMBL4748265)
Show SMILES COc1cn(ccc1=O)-c1ccc(OCCCN2CCCC2)cc1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 0.520n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human histamine H3 receptor expressed in HEK293 cells preincubated for 5 mins followed by forskolin-stimulation and measured a...


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.113096
BindingDB Entry DOI: 10.7270/Q2T72N5B
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM50562729
PNG
(CHEMBL4748265)
Show SMILES COc1cn(ccc1=O)-c1ccc(OCCCN2CCCC2)cc1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human histamine H4 receptor expressed in HEK293 cells preincubated for 5 mins followed by forskolin-stimulation and measured a...


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.113096
BindingDB Entry DOI: 10.7270/Q2T72N5B
More data for this
Ligand-Target Pair
Histamine H2 receptor


(Homo sapiens (Human))
BDBM50562729
PNG
(CHEMBL4748265)
Show SMILES COc1cn(ccc1=O)-c1ccc(OCCCN2CCCC2)cc1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human histamine H2 receptor expressed in HEK293 cells preincubated for 5 mins followed by forskolin-stimulation and measured a...


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.113096
BindingDB Entry DOI: 10.7270/Q2T72N5B
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))
BDBM50562729
PNG
(CHEMBL4748265)
Show SMILES COc1cn(ccc1=O)-c1ccc(OCCCN2CCCC2)cc1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a


TBA

Assay Description
Antagonist activity at human histamine H1 receptor expressed in HEK293 cells preincubated for 5 mins followed by forskolin-stimulation and measured a...


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.113096
BindingDB Entry DOI: 10.7270/Q2T72N5B
More data for this
Ligand-Target Pair