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BDBM50131927 (2-Benzofuran-2-yl-oxazol-4-ylmethyl)-{2-[4-(2-methoxy-phenyl)-piperazin-1-yl]-ethyl}-amine::CHEMBL341117

SMILES: COc1ccccc1N1CCN(CCNCc2coc(n2)-c2cc3ccccc3o2)CC1

InChI Key: InChIKey=JCBILKVEETVNCO-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50131927   
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


(Rattus norvegicus (rat))
BDBM50131927
PNG
((2-Benzofuran-2-yl-oxazol-4-ylmethyl)-{2-[4-(2-met...)
Show SMILES COc1ccccc1N1CCN(CCNCc2coc(n2)-c2cc3ccccc3o2)CC1
Show InChI InChI=1S/C25H28N4O3/c1-30-23-9-5-3-7-21(23)29-14-12-28(13-15-29)11-10-26-17-20-18-31-25(27-20)24-16-19-6-2-4-8-22(19)32-24/h2-9,16,18,26H,10-15,17H2,1H3
PDB

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KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
518n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity for rat striatum Dopamine receptor D2 by [3H]spiperone displacement.


J Med Chem 46: 3822-39 (2003)


Article DOI: 10.1021/jm0211220
BindingDB Entry DOI: 10.7270/Q2H132RF
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Rattus norvegicus (Rat))
BDBM50131927
PNG
((2-Benzofuran-2-yl-oxazol-4-ylmethyl)-{2-[4-(2-met...)
Show SMILES COc1ccccc1N1CCN(CCNCc2coc(n2)-c2cc3ccccc3o2)CC1
Show InChI InChI=1S/C25H28N4O3/c1-30-23-9-5-3-7-21(23)29-14-12-28(13-15-29)11-10-26-17-20-18-31-25(27-20)24-16-19-6-2-4-8-22(19)32-24/h2-9,16,18,26H,10-15,17H2,1H3
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
759n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity for rat striatum Dopamine receptor D3 (sf9 cells) by [3H]7-OH-DPAT displacement.


J Med Chem 46: 3822-39 (2003)


Article DOI: 10.1021/jm0211220
BindingDB Entry DOI: 10.7270/Q2H132RF
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(RAT)
BDBM50131927
PNG
((2-Benzofuran-2-yl-oxazol-4-ylmethyl)-{2-[4-(2-met...)
Show SMILES COc1ccccc1N1CCN(CCNCc2coc(n2)-c2cc3ccccc3o2)CC1
Show InChI InChI=1S/C25H28N4O3/c1-30-23-9-5-3-7-21(23)29-14-12-28(13-15-29)11-10-26-17-20-18-31-25(27-20)24-16-19-6-2-4-8-22(19)32-24/h2-9,16,18,26H,10-15,17H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Universit£ di Siena

Curated by ChEMBL


Assay Description
Binding affinity for rat striatum dopamine Dopamine receptor D1 by [3H]-SCH- -2339 displacement.


J Med Chem 46: 3822-39 (2003)


Article DOI: 10.1021/jm0211220
BindingDB Entry DOI: 10.7270/Q2H132RF
More data for this
Ligand-Target Pair