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SMILES: CN(CCN1CCN(C2COOC2)C1=O)C[C@@]12CC[C@@H](CC1)C2(C)C

InChI Key: InChIKey=PFWZDYSBLPIXBI-GLRZTSSQSA-N

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50414987   
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
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50414987
PNG
(CHEMBL567919)
Show SMILES CN(CCN1CCN(C2COOC2)C1=O)C[C@@]12CC[C@@H](CC1)C2(C)C |r|
Show InChI InChI=1S/C19H33N3O3/c1-18(2)15-4-6-19(18,7-5-15)14-20(3)8-9-21-10-11-22(17(21)23)16-12-24-25-13-16/h15-16H,4-14H2,1-3H3/t15-,19+
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
50.1n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Binding affinity to human DRD3 receptor by GTPgammaS binding assay


Bioorg Med Chem Lett 19: 5056-9 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.055
BindingDB Entry DOI: 10.7270/Q2PR7X7C
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50414987
PNG
(CHEMBL567919)
Show SMILES CN(CCN1CCN(C2COOC2)C1=O)C[C@@]12CC[C@@H](CC1)C2(C)C |r|
Show InChI InChI=1S/C19H33N3O3/c1-18(2)15-4-6-19(18,7-5-15)14-20(3)8-9-21-10-11-22(17(21)23)16-12-24-25-13-16/h15-16H,4-14H2,1-3H3/t15-,19+
PDB

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KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
1.58E+3n/an/an/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Binding affinity to human DRD2 receptor by GTPgammaS binding assay


Bioorg Med Chem Lett 19: 5056-9 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.055
BindingDB Entry DOI: 10.7270/Q2PR7X7C
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50414987
PNG
(CHEMBL567919)
Show SMILES CN(CCN1CCN(C2COOC2)C1=O)C[C@@]12CC[C@@H](CC1)C2(C)C |r|
Show InChI InChI=1S/C19H33N3O3/c1-18(2)15-4-6-19(18,7-5-15)14-20(3)8-9-21-10-11-22(17(21)23)16-12-24-25-13-16/h15-16H,4-14H2,1-3H3/t15-,19+
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
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antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 6.31E+3n/an/an/an/an/an/a



Imperial College London

Curated by ChEMBL


Assay Description
Displacement of [3H]dofetilide from human ERG


Bioorg Med Chem Lett 19: 5056-9 (2009)


Article DOI: 10.1016/j.bmcl.2009.07.055
BindingDB Entry DOI: 10.7270/Q2PR7X7C
More data for this
Ligand-Target Pair