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BDBM50372289 CHEMBL270595

SMILES: C(Cc1ccccn1)N1CCCC1

InChI Key: InChIKey=OXEFHEYEQUISKC-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50372289   
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


(Rattus norvegicus (rat))
BDBM50372289
PNG
(CHEMBL270595)
Show SMILES C(Cc1ccccn1)N1CCCC1
Show InChI InChI=1S/C11H16N2/c1-2-7-12-11(5-1)6-10-13-8-3-4-9-13/h1-2,5,7H,3-4,6,8-10H2
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320n/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 H3 receptor


(Homo sapiens (Human))
BDBM50372289
PNG
(CHEMBL270595)
Show SMILES C(Cc1ccccn1)N1CCCC1
Show InChI InChI=1S/C11H16N2/c1-2-7-12-11(5-1)6-10-13-8-3-4-9-13/h1-2,5,7H,3-4,6,8-10H2
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PubMed
>350n/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
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50372289
PNG
(CHEMBL270595)
Show SMILES C(Cc1ccccn1)N1CCCC1
Show InChI InChI=1S/C11H16N2/c1-2-7-12-11(5-1)6-10-13-8-3-4-9-13/h1-2,5,7H,3-4,6,8-10H2
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PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of SERT


Bioorg Med Chem Lett 22: 4059-63 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.077
BindingDB Entry DOI: 10.7270/Q2CF9R4T
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50372289
PNG
(CHEMBL270595)
Show SMILES C(Cc1ccccn1)N1CCCC1
Show InChI InChI=1S/C11H16N2/c1-2-7-12-11(5-1)6-10-13-8-3-4-9-13/h1-2,5,7H,3-4,6,8-10H2
PDB

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PC cid
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Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



The University of Sydney

Curated by ChEMBL


Assay Description
Inhibition of D2 dopamine receptor


Bioorg Med Chem Lett 22: 4059-63 (2012)


Article DOI: 10.1016/j.bmcl.2012.04.077
BindingDB Entry DOI: 10.7270/Q2CF9R4T
More data for this
Ligand-Target Pair