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BDBM50156946 CHEMBL3793996

SMILES: C(Oc1ccccc1)[C@@H]1CN(Cc2n[nH]c3ccccc23)CCO1

InChI Key: InChIKey=JOEVLLWWSOHRQB-INIZCTEOSA-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
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50156946   
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))
BDBM50156946
PNG
(CHEMBL3793996)
Show SMILES C(Oc1ccccc1)[C@@H]1CN(Cc2n[nH]c3ccccc23)CCO1 |r|
Show InChI InChI=1S/C19H21N3O2/c1-2-6-15(7-3-1)24-14-16-12-22(10-11-23-16)13-19-17-8-4-5-9-18(17)20-21-19/h1-9,16H,10-14H2,(H,20,21)/t16-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
18n/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))
BDBM50156946
PNG
(CHEMBL3793996)
Show SMILES C(Oc1ccccc1)[C@@H]1CN(Cc2n[nH]c3ccccc23)CCO1 |r|
Show InChI InChI=1S/C19H21N3O2/c1-2-6-15(7-3-1)24-14-16-12-22(10-11-23-16)13-19-17-8-4-5-9-18(17)20-21-19/h1-9,16H,10-14H2,(H,20,21)/t16-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 65n/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