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BDBM50290025 5-Chloro-2-[1-(4-chloro-benzyl)-1,2,3,6-tetrahydro-pyridin-4-yl]-benzooxazole::CHEMBL71208

SMILES: Clc1ccc(CN2CCC(=CC2)c2nc3cc(Cl)ccc3o2)cc1

InChI Key: InChIKey=OETFULLTUNJRQW-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 = 50290025   
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))
BDBM50290025
PNG
(5-Chloro-2-[1-(4-chloro-benzyl)-1,2,3,6-tetrahydro...)
Show SMILES Clc1ccc(CN2CCC(=CC2)c2nc3cc(Cl)ccc3o2)cc1 |c:9|
Show InChI InChI=1S/C19H16Cl2N2O/c20-15-3-1-13(2-4-15)12-23-9-7-14(8-10-23)19-22-17-11-16(21)5-6-18(17)24-19/h1-7,11H,8-10,12H2
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Article
8.40n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]-spiperone from human dopamine receptor subtype hD4 expressed in HEK293 cells


Bioorg Med Chem Lett 7: 2211-2216 (1997)


Article DOI: 10.1016/S0960-894X(97)00402-2
BindingDB Entry DOI: 10.7270/Q2QR4X46
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50290025
PNG
(5-Chloro-2-[1-(4-chloro-benzyl)-1,2,3,6-tetrahydro...)
Show SMILES Clc1ccc(CN2CCC(=CC2)c2nc3cc(Cl)ccc3o2)cc1 |c:9|
Show InChI InChI=1S/C19H16Cl2N2O/c20-15-3-1-13(2-4-15)12-23-9-7-14(8-10-23)19-22-17-11-16(21)5-6-18(17)24-19/h1-7,11H,8-10,12H2
PDB

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Article
>1.70E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]-spiperone from human dopamine D2 receptor in CHO cells


Bioorg Med Chem Lett 7: 2211-2216 (1997)


Article DOI: 10.1016/S0960-894X(97)00402-2
BindingDB Entry DOI: 10.7270/Q2QR4X46
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50290025
PNG
(5-Chloro-2-[1-(4-chloro-benzyl)-1,2,3,6-tetrahydro...)
Show SMILES Clc1ccc(CN2CCC(=CC2)c2nc3cc(Cl)ccc3o2)cc1 |c:9|
Show InChI InChI=1S/C19H16Cl2N2O/c20-15-3-1-13(2-4-15)12-23-9-7-14(8-10-23)19-22-17-11-16(21)5-6-18(17)24-19/h1-7,11H,8-10,12H2
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents


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Article
>4.50E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]-spiperone from human dopamine receptor subtype hD3 expressed in CHO cells


Bioorg Med Chem Lett 7: 2211-2216 (1997)


Article DOI: 10.1016/S0960-894X(97)00402-2
BindingDB Entry DOI: 10.7270/Q2QR4X46
More data for this
Ligand-Target Pair