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BDBM50156957 CHEMBL3794336

SMILES: C(Oc1ccccc1)[C@@H]1CN(Cc2ccc3ccccc3n2)CCO1

InChI Key: InChIKey=JVZDFSQUEOLSKZ-FQEVSTJZSA-N

Data: 1 KI  1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50156957   
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(4) dopamine receptor


(Homo sapiens (Human))
BDBM50156957
PNG
(CHEMBL3794336)
Show SMILES C(Oc1ccccc1)[C@@H]1CN(Cc2ccc3ccccc3n2)CCO1 |r|
Show InChI InChI=1S/C21H22N2O2/c1-2-7-19(8-3-1)25-16-20-15-23(12-13-24-20)14-18-11-10-17-6-4-5-9-21(17)22-18/h1-11,20H,12-16H2/t20-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
310n/an/an/an/an/an/an/an/a



Vanderbilt University

Curated by ChEMBL


Assay Description
Displacement of [3H]-Spiperone from human recombinant dopamine D4 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 26: 2481-8 (2016)


BindingDB Entry DOI: 10.7270/Q2G44S5M
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50156957
PNG
(CHEMBL3794336)
Show SMILES C(Oc1ccccc1)[C@@H]1CN(Cc2ccc3ccccc3n2)CCO1 |r|
Show InChI InChI=1S/C21H22N2O2/c1-2-7-19(8-3-1)25-16-20-15-23(12-13-24-20)14-18-11-10-17-6-4-5-9-21(17)22-18/h1-11,20H,12-16H2/t20-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 1.11E+3n/an/an/an/an/an/a



Vanderbilt University

Curated by ChEMBL


Assay Description
Displacement of [3H]-Spiperone from human recombinant dopamine D4 receptor expressed in CHOK1 cells


Bioorg Med Chem Lett 26: 2481-8 (2016)


BindingDB Entry DOI: 10.7270/Q2G44S5M
More data for this
Ligand-Target Pair