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BDBM50418065 CHEMBL1688975

SMILES: C(Cc1cnc[nH]1)Cn1cc(CC2CCCCCC2)nn1

InChI Key: InChIKey=VQTUECJHHAWNKZ-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 = 50418065   
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 H4 receptor


(Homo sapiens (Human))
BDBM50418065
PNG
(CHEMBL1688975)
Show SMILES C(Cc1cnc[nH]1)Cn1cc(CC2CCCCCC2)nn1
Show InChI InChI=1S/C16H25N5/c1-2-4-7-14(6-3-1)10-16-12-21(20-19-16)9-5-8-15-11-17-13-18-15/h11-14H,1-10H2,(H,17,18)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
55.0n/an/an/an/an/an/an/an/a



VU University Amsterdam

Curated by ChEMBL


Assay Description
Displacement of [3H]histamine from human histamine H4 receptor expressed in HEK293 cells after 60 mins by liquid scintillation counting


J Med Chem 54: 1693-703 (2011)


Article DOI: 10.1021/jm1013488
BindingDB Entry DOI: 10.7270/Q20G3MDD
More data for this
Ligand-Target Pair
Histamine receptor (H3)


(Homo sapiens (Human))
BDBM50418065
PNG
(CHEMBL1688975)
Show SMILES C(Cc1cnc[nH]1)Cn1cc(CC2CCCCCC2)nn1
Show InChI InChI=1S/C16H25N5/c1-2-4-7-14(6-3-1)10-16-12-21(20-19-16)9-5-8-15-11-17-13-18-15/h11-14H,1-10H2,(H,17,18)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
112n/an/an/an/an/an/an/an/a



VU University Amsterdam

Curated by ChEMBL


Assay Description
Displacement of [3H]N-alpha-methylhistamine from human histamine H3 receptor expressed in HEK293 cells after 60 mins by liquid scintillation counting


J Med Chem 54: 1693-703 (2011)


Article DOI: 10.1021/jm1013488
BindingDB Entry DOI: 10.7270/Q20G3MDD
More data for this
Ligand-Target Pair