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BDBM50474429 CHEMBL150243

SMILES: C1CC(=CCN1)c1c[nH]cn1

InChI Key: InChIKey=NYMBHXQAMFVNIG-UHFFFAOYSA-N

Data: 2 KI  2 EC50

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 = 50474429   
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))
BDBM50474429
PNG
(CHEMBL150243)
Show SMILES C1CC(=CCN1)c1c[nH]cn1 |c:2|
Show InChI InChI=1S/C8H11N3/c1-3-9-4-2-7(1)8-5-10-6-11-8/h1,5-6,9H,2-4H2,(H,10,11)
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PC sid
UniChem
Article
PubMed
4.27E+3n/an/an/an/an/an/an/an/a



Vrije Universiteit

Curated by ChEMBL


Assay Description
Inhibitory activity measured by [3H]- N alpha- methyl-histamine binding to membranes of SK-N-MC cells expressing the human Histamine H3 receptor


J Med Chem 46: 5445-57 (2003)


Article DOI: 10.1021/jm030905y
BindingDB Entry DOI: 10.7270/Q2FN18X0
More data for this
Ligand-Target Pair
Histamine receptor (H3 and H4)


(Homo sapiens (Human))
BDBM50474429
PNG
(CHEMBL150243)
Show SMILES C1CC(=CCN1)c1c[nH]cn1 |c:2|
Show InChI InChI=1S/C8H11N3/c1-3-9-4-2-7(1)8-5-10-6-11-8/h1,5-6,9H,2-4H2,(H,10,11)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
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PC cid
PC sid
UniChem
Article
PubMed
3.80E+12n/an/an/an/an/an/an/an/a



Vrije Universiteit

Curated by ChEMBL


Assay Description
Inhibitory activity measured by [3H]- N alpha- methyl-histamine binding to membranes of SK-N-MC cells expressing the human Histamine H4 receptor


J Med Chem 46: 5445-57 (2003)


Article DOI: 10.1021/jm030905y
BindingDB Entry DOI: 10.7270/Q2FN18X0
More data for this
Ligand-Target Pair
Histamine receptor (H3 and H4)


(Homo sapiens (Human))
BDBM50474429
PNG
(CHEMBL150243)
Show SMILES C1CC(=CCN1)c1c[nH]cn1 |c:2|
Show InChI InChI=1S/C8H11N3/c1-3-9-4-2-7(1)8-5-10-6-11-8/h1,5-6,9H,2-4H2,(H,10,11)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a<1.00E+4n/an/an/an/a



Vrije Universiteit

Curated by ChEMBL


Assay Description
Inhibitory activity determined by the inhibition of cAMP- stimulated beta-galactosidase transcription in SK-N-MC cells expressing the human Histamine...


J Med Chem 46: 5445-57 (2003)


Article DOI: 10.1021/jm030905y
BindingDB Entry DOI: 10.7270/Q2FN18X0
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50474429
PNG
(CHEMBL150243)
Show SMILES C1CC(=CCN1)c1c[nH]cn1 |c:2|
Show InChI InChI=1S/C8H11N3/c1-3-9-4-2-7(1)8-5-10-6-11-8/h1,5-6,9H,2-4H2,(H,10,11)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 1.51E+3n/an/an/an/a



Vrije Universiteit

Curated by ChEMBL


Assay Description
Inhibitory activity determined by the inhibition of cAMP- stimulated beta-galactosidase transcription in SK-N-MC cells expressing the human Histamine...


J Med Chem 46: 5445-57 (2003)


Article DOI: 10.1021/jm030905y
BindingDB Entry DOI: 10.7270/Q2FN18X0
More data for this
Ligand-Target Pair