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SMILES: COc1cc(CN2CCN(CC2)c2ccccc2OC)ccc1OCCF

InChI Key: InChIKey=FKHJOYFNYFVDRF-UHFFFAOYSA-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 4 hits for monomerid = 50373708   
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(2) dopamine receptor


(Homo sapiens (Human))
BDBM50373708
PNG
(CHEMBL256492)
Show SMILES COc1cc(CN2CCN(CC2)c2ccccc2OC)ccc1OCCF
Show InChI InChI=1S/C21H27FN2O3/c1-25-19-6-4-3-5-18(19)24-12-10-23(11-13-24)16-17-7-8-20(27-14-9-22)21(15-17)26-2/h3-8,15H,9-14,16H2,1-2H3
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Article
PubMed
310n/an/an/an/an/an/an/an/a



Clinic of Nuclear Medicine

Curated by ChEMBL


Assay Description
Binding affinity to human dopamine D2 long receptor


Bioorg Med Chem Lett 18: 983-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.026
BindingDB Entry DOI: 10.7270/Q2B56KMT
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50373708
PNG
(CHEMBL256492)
Show SMILES COc1cc(CN2CCN(CC2)c2ccccc2OC)ccc1OCCF
Show InChI InChI=1S/C21H27FN2O3/c1-25-19-6-4-3-5-18(19)24-12-10-23(11-13-24)16-17-7-8-20(27-14-9-22)21(15-17)26-2/h3-8,15H,9-14,16H2,1-2H3
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1.10E+3n/an/an/an/an/an/an/an/a



Clinic of Nuclear Medicine

Curated by ChEMBL


Assay Description
Binding affinity to human D3 receptor


Bioorg Med Chem Lett 18: 983-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.026
BindingDB Entry DOI: 10.7270/Q2B56KMT
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(PIG)
BDBM50373708
PNG
(CHEMBL256492)
Show SMILES COc1cc(CN2CCN(CC2)c2ccccc2OC)ccc1OCCF
Show InChI InChI=1S/C21H27FN2O3/c1-25-19-6-4-3-5-18(19)24-12-10-23(11-13-24)16-17-7-8-20(27-14-9-22)21(15-17)26-2/h3-8,15H,9-14,16H2,1-2H3
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PubMed
2.10E+3n/an/an/an/an/an/an/an/a



Clinic of Nuclear Medicine

Curated by ChEMBL


Assay Description
Displacement of [3H]ketanserin from pig cortical membrane 5HT2 receptor


Bioorg Med Chem Lett 18: 983-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.026
BindingDB Entry DOI: 10.7270/Q2B56KMT
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(Sus scrofa)
BDBM50373708
PNG
(CHEMBL256492)
Show SMILES COc1cc(CN2CCN(CC2)c2ccccc2OC)ccc1OCCF
Show InChI InChI=1S/C21H27FN2O3/c1-25-19-6-4-3-5-18(19)24-12-10-23(11-13-24)16-17-7-8-20(27-14-9-22)21(15-17)26-2/h3-8,15H,9-14,16H2,1-2H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
5.40E+3n/an/an/an/an/an/an/an/a



Clinic of Nuclear Medicine

Curated by ChEMBL


Assay Description
Binding affinity to pig cortical membrane dopamine D1 receptor


Bioorg Med Chem Lett 18: 983-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.026
BindingDB Entry DOI: 10.7270/Q2B56KMT
More data for this
Ligand-Target Pair