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BDBM50372296 CHEMBL402377

SMILES: C[C@H]1CCCN1CCc1ccc2ccccc2c1

InChI Key: InChIKey=PSTMOSWQMHZABO-AWEZNQCLSA-N

Data: 5 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 5 hits for monomerid = 50372296   
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 receptor (H3)


(Homo sapiens (Human))
BDBM50372296
PNG
(CHEMBL402377)
Show SMILES C[C@H]1CCCN1CCc1ccc2ccccc2c1
Show InChI InChI=1S/C17H21N/c1-14-5-4-11-18(14)12-10-15-8-9-16-6-2-3-7-17(16)13-15/h2-3,6-9,13-14H,4-5,10-12H2,1H3/t14-/m0/s1
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PubMed
14n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity at human recombinant histamine H3 receptor expressed in HEK cells


Bioorg Med Chem Lett 18: 355-9 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.067
BindingDB Entry DOI: 10.7270/Q2VM4D4V
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50372296
PNG
(CHEMBL402377)
Show SMILES C[C@H]1CCCN1CCc1ccc2ccccc2c1
Show InChI InChI=1S/C17H21N/c1-14-5-4-11-18(14)12-10-15-8-9-16-6-2-3-7-17(16)13-15/h2-3,6-9,13-14H,4-5,10-12H2,1H3/t14-/m0/s1
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UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
89n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity at rat recombinant histamine H3 receptor in rat cortical membranes


Bioorg Med Chem Lett 18: 355-9 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.067
BindingDB Entry DOI: 10.7270/Q2VM4D4V
More data for this
Ligand-Target Pair
Histamine H2 Receptor


(Homo sapiens (Human))
BDBM50372296
PNG
(CHEMBL402377)
Show SMILES C[C@H]1CCCN1CCc1ccc2ccccc2c1
Show InChI InChI=1S/C17H21N/c1-14-5-4-11-18(14)12-10-15-8-9-16-6-2-3-7-17(16)13-15/h2-3,6-9,13-14H,4-5,10-12H2,1H3/t14-/m0/s1
Reactome pathway
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GoogleScholar
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PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at histamine H2 receptor by [35S]GTP-gamma-S binding assay


Bioorg Med Chem Lett 18: 355-9 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.067
BindingDB Entry DOI: 10.7270/Q2VM4D4V
More data for this
Ligand-Target Pair
Histamine H1 receptor


(Homo sapiens (Human))
BDBM50372296
PNG
(CHEMBL402377)
Show SMILES C[C@H]1CCCN1CCc1ccc2ccccc2c1
Show InChI InChI=1S/C17H21N/c1-14-5-4-11-18(14)12-10-15-8-9-16-6-2-3-7-17(16)13-15/h2-3,6-9,13-14H,4-5,10-12H2,1H3/t14-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at histamine H1 receptor by [35S]GTP-gamma-S binding assay


Bioorg Med Chem Lett 18: 355-9 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.067
BindingDB Entry DOI: 10.7270/Q2VM4D4V
More data for this
Ligand-Target Pair
Histamine H4 receptor


(Homo sapiens (Human))
BDBM50372296
PNG
(CHEMBL402377)
Show SMILES C[C@H]1CCCN1CCc1ccc2ccccc2c1
Show InChI InChI=1S/C17H21N/c1-14-5-4-11-18(14)12-10-15-8-9-16-6-2-3-7-17(16)13-15/h2-3,6-9,13-14H,4-5,10-12H2,1H3/t14-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at histamine H4 receptor by [35S]GTP-gamma-S binding assay


Bioorg Med Chem Lett 18: 355-9 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.067
BindingDB Entry DOI: 10.7270/Q2VM4D4V
More data for this
Ligand-Target Pair