BindingDB logo
myBDB logout

null

SMILES: C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1nccs1

InChI Key: InChIKey=UHGSEJDZVOPSFT-CQSZACIVSA-N

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 = 50319506   
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))
BDBM50319506
PNG
((R)-2-(6-(2-(2-methylpyrrolidin-1-yl)ethyl)quinoli...)
Show SMILES C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1nccs1 |r|
Show InChI InChI=1S/C19H21N3S/c1-14-3-2-10-22(14)11-8-15-4-6-17-16(13-15)5-7-18(21-17)19-20-9-12-23-19/h4-7,9,12-14H,2-3,8,10-11H2,1H3/t14-/m1/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
0.400n/an/an/an/an/an/an/an/a



Bioprojet-Biotech

Curated by ChEMBL


Assay Description
Displacement of [125I]Iodoproxyfan from human recombinant histamine H3 receptor by Competitive binding assay


Bioorg Med Chem Lett 21: 5378-83 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.006
BindingDB Entry DOI: 10.7270/Q2VX0GXK
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50319506
PNG
((R)-2-(6-(2-(2-methylpyrrolidin-1-yl)ethyl)quinoli...)
Show SMILES C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1nccs1 |r|
Show InChI InChI=1S/C19H21N3S/c1-14-3-2-10-22(14)11-8-15-4-6-17-16(13-15)5-7-18(21-17)19-20-9-12-23-19/h4-7,9,12-14H,2-3,8,10-11H2,1H3/t14-/m1/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
0.440n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from human cloned histamine H3 receptor


Bioorg Med Chem Lett 20: 3295-300 (2010)


Article DOI: 10.1016/j.bmcl.2010.04.045
BindingDB Entry DOI: 10.7270/Q2XW4JZN
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50319506
PNG
((R)-2-(6-(2-(2-methylpyrrolidin-1-yl)ethyl)quinoli...)
Show SMILES C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1nccs1 |r|
Show InChI InChI=1S/C19H21N3S/c1-14-3-2-10-22(14)11-8-15-4-6-17-16(13-15)5-7-18(21-17)19-20-9-12-23-19/h4-7,9,12-14H,2-3,8,10-11H2,1H3/t14-/m1/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
1.60n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-N-alpha-methylhistamine from rat cloned histamine H3 receptor


Bioorg Med Chem Lett 20: 3295-300 (2010)


Article DOI: 10.1016/j.bmcl.2010.04.045
BindingDB Entry DOI: 10.7270/Q2XW4JZN
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50319506
PNG
((R)-2-(6-(2-(2-methylpyrrolidin-1-yl)ethyl)quinoli...)
Show SMILES C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1nccs1 |r|
Show InChI InChI=1S/C19H21N3S/c1-14-3-2-10-22(14)11-8-15-4-6-17-16(13-15)5-7-18(21-17)19-20-9-12-23-19/h4-7,9,12-14H,2-3,8,10-11H2,1H3/t14-/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
2.90E+3n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]dofetilide from human ERG expressed in HEK293 cells


Bioorg Med Chem Lett 20: 3295-300 (2010)


Article DOI: 10.1016/j.bmcl.2010.04.045
BindingDB Entry DOI: 10.7270/Q2XW4JZN
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50319506
PNG
((R)-2-(6-(2-(2-methylpyrrolidin-1-yl)ethyl)quinoli...)
Show SMILES C[C@@H]1CCCN1CCc1ccc2nc(ccc2c1)-c1nccs1 |r|
Show InChI InChI=1S/C19H21N3S/c1-14-3-2-10-22(14)11-8-15-4-6-17-16(13-15)5-7-18(21-17)19-20-9-12-23-19/h4-7,9,12-14H,2-3,8,10-11H2,1H3/t14-/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.16E+4n/an/an/an/an/an/a



Bioprojet-Biotech

Curated by ChEMBL


Assay Description
Displacement of [3H]dofetilide from human recombinant ERG by Competitive binding assay


Bioorg Med Chem Lett 21: 5378-83 (2011)


Article DOI: 10.1016/j.bmcl.2011.07.006
BindingDB Entry DOI: 10.7270/Q2VX0GXK
More data for this
Ligand-Target Pair