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BDBM50092039 3-[4-(4-Methyl-benzyl)-piperazin-1-yl]-1,3-dihydro-indol-2-one::CHEMBL68190

SMILES: Cc1ccc(CN2CCN(CC2)C2C(=O)Nc3ccccc23)cc1

InChI Key: InChIKey=ZMGATMJPVZPSCU-UHFFFAOYSA-N

Data: 2 KI

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   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 = 50092039   
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))
BDBM50092039
PNG
(3-[4-(4-Methyl-benzyl)-piperazin-1-yl]-1,3-dihydro...)
Show SMILES Cc1ccc(CN2CCN(CC2)C2C(=O)Nc3ccccc23)cc1
Show InChI InChI=1S/C20H23N3O/c1-15-6-8-16(9-7-15)14-22-10-12-23(13-11-22)19-17-4-2-3-5-18(17)21-20(19)24/h2-9,19H,10-14H2,1H3,(H,21,24)
PDB

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PC cid
PC sid
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Similars

PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Neurogen Corporation

Curated by ChEMBL


Assay Description
Binding affinity at human Dopamine receptor D2 by [3H]- YM 09151 displacement.


Bioorg Med Chem Lett 10: 2119-22 (2000)


BindingDB Entry DOI: 10.7270/Q2SN0869
More data for this
Ligand-Target Pair
D(4) dopamine receptor


(Homo sapiens (Human))
BDBM50092039
PNG
(3-[4-(4-Methyl-benzyl)-piperazin-1-yl]-1,3-dihydro...)
Show SMILES Cc1ccc(CN2CCN(CC2)C2C(=O)Nc3ccccc23)cc1
Show InChI InChI=1S/C20H23N3O/c1-15-6-8-16(9-7-15)14-22-10-12-23(13-11-22)19-17-4-2-3-5-18(17)21-20(19)24/h2-9,19H,10-14H2,1H3,(H,21,24)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Neurogen Corporation

Curated by ChEMBL


Assay Description
Binding affinity at human Dopamine receptor D4 by [3H]- YM 09151 displacement.


Bioorg Med Chem Lett 10: 2119-22 (2000)


BindingDB Entry DOI: 10.7270/Q2SN0869
More data for this
Ligand-Target Pair