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BDBM50155523 4-[3-(4-Chloro-phenyl)-8-aza-bicyclo[3.2.1]oct-8-yl]-1-(4-fluoro-phenyl)-butan-1-one; hydrochloride::CHEMBL537182

SMILES: Fc1ccc(cc1)C(=O)CCCN1C2CCC1CC(C2)c1ccc(Cl)cc1

InChI Key: InChIKey=NZHOOCMJJHYQQC-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50155523   
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))
BDBM50155523
PNG
(4-[3-(4-Chloro-phenyl)-8-aza-bicyclo[3.2.1]oct-8-y...)
Show SMILES Fc1ccc(cc1)C(=O)CCCN1C2CCC1CC(C2)c1ccc(Cl)cc1 |TLB:11:12:18.19.17:14.15|
Show InChI InChI=1S/C23H25ClFNO/c24-19-7-3-16(4-8-19)18-14-21-11-12-22(15-18)26(21)13-1-2-23(27)17-5-9-20(25)10-6-17/h3-10,18,21-22H,1-2,11-15H2
PDB

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KEGG

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PC cid
PC sid
UniChem

Similars

Article
PubMed
190n/an/an/an/an/an/an/an/a



Florida A& M University

Curated by ChEMBL


Assay Description
Binding affinity for dopamine D2 receptor


Bioorg Med Chem Lett 14: 5739-42 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.046
BindingDB Entry DOI: 10.7270/Q28K79VJ
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50155523
PNG
(4-[3-(4-Chloro-phenyl)-8-aza-bicyclo[3.2.1]oct-8-y...)
Show SMILES Fc1ccc(cc1)C(=O)CCCN1C2CCC1CC(C2)c1ccc(Cl)cc1 |TLB:11:12:18.19.17:14.15|
Show InChI InChI=1S/C23H25ClFNO/c24-19-7-3-16(4-8-19)18-14-21-11-12-22(15-18)26(21)13-1-2-23(27)17-5-9-20(25)10-6-17/h3-10,18,21-22H,1-2,11-15H2
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
345n/an/an/an/an/an/an/an/a



Florida A& M University

Curated by ChEMBL


Assay Description
Binding affinity for dopamine D4 receptor


Bioorg Med Chem Lett 14: 5739-42 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.046
BindingDB Entry DOI: 10.7270/Q28K79VJ
More data for this
Ligand-Target Pair