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BDBM50109947 3-[4-(4-Chloro-phenyl)-piperazin-1-ylmethyl]-7-trimethylsilanyl-pyrazolo[1,5-a]pyridine::CHEMBL160454

SMILES: C[Si](C)(C)c1cccc2c(CN3CCN(CC3)c3ccc(Cl)cc3)cnn12

InChI Key: InChIKey=VLCYCTQMMKCUDI-UHFFFAOYSA-N

Data: 5 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 5 hits for monomerid = 50109947   
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))
BDBM50109947
PNG
(3-[4-(4-Chloro-phenyl)-piperazin-1-ylmethyl]-7-tri...)
Show SMILES C[Si](C)(C)c1cccc2c(CN3CCN(CC3)c3ccc(Cl)cc3)cnn12
Show InChI InChI=1S/C21H27ClN4Si/c1-27(2,3)21-6-4-5-20-17(15-23-26(20)21)16-24-11-13-25(14-12-24)19-9-7-18(22)8-10-19/h4-10,15H,11-14,16H2,1-3H3
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PC sid
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2.80n/an/an/an/an/an/an/an/a



Friedrich-Alexander University

Curated by ChEMBL


Assay Description
In vitro binding affinity at human cloned dopamine receptor D4 stably expressed in CHO cells by [3H]spiperone displacement.


Bioorg Med Chem Lett 12: 633-6 (2002)


BindingDB Entry DOI: 10.7270/Q2JM2B5X
More data for this
Ligand-Target Pair
D(3) dopamine receptor


(Homo sapiens (Human))
BDBM50109947
PNG
(3-[4-(4-Chloro-phenyl)-piperazin-1-ylmethyl]-7-tri...)
Show SMILES C[Si](C)(C)c1cccc2c(CN3CCN(CC3)c3ccc(Cl)cc3)cnn12
Show InChI InChI=1S/C21H27ClN4Si/c1-27(2,3)21-6-4-5-20-17(15-23-26(20)21)16-24-11-13-25(14-12-24)19-9-7-18(22)8-10-19/h4-10,15H,11-14,16H2,1-3H3
PDB

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PC sid
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2.00E+3n/an/an/an/an/an/an/an/a



Friedrich-Alexander University

Curated by ChEMBL


Assay Description
In vitro binding affinity at human cloned dopamine receptor D3 stably expressed in CHO cells by [3H]spiperone displacement.


Bioorg Med Chem Lett 12: 633-6 (2002)


BindingDB Entry DOI: 10.7270/Q2JM2B5X
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50109947
PNG
(3-[4-(4-Chloro-phenyl)-piperazin-1-ylmethyl]-7-tri...)
Show SMILES C[Si](C)(C)c1cccc2c(CN3CCN(CC3)c3ccc(Cl)cc3)cnn12
Show InChI InChI=1S/C21H27ClN4Si/c1-27(2,3)21-6-4-5-20-17(15-23-26(20)21)16-24-11-13-25(14-12-24)19-9-7-18(22)8-10-19/h4-10,15H,11-14,16H2,1-3H3
PDB

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2.80E+3n/an/an/an/an/an/an/an/a



Friedrich-Alexander University

Curated by ChEMBL


Assay Description
In vitro binding affinity at human cloned dopamine receptor D2 (long) stably expressed in CHO cells by [3H]-Spiperone displacement.


Bioorg Med Chem Lett 12: 633-6 (2002)


BindingDB Entry DOI: 10.7270/Q2JM2B5X
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50109947
PNG
(3-[4-(4-Chloro-phenyl)-piperazin-1-ylmethyl]-7-tri...)
Show SMILES C[Si](C)(C)c1cccc2c(CN3CCN(CC3)c3ccc(Cl)cc3)cnn12
Show InChI InChI=1S/C21H27ClN4Si/c1-27(2,3)21-6-4-5-20-17(15-23-26(20)21)16-24-11-13-25(14-12-24)19-9-7-18(22)8-10-19/h4-10,15H,11-14,16H2,1-3H3
PDB

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3.10E+3n/an/an/an/an/an/an/an/a



Friedrich-Alexander University

Curated by ChEMBL


Assay Description
In vitro binding affinity at human cloned dopamine receptor D2 (long) stably expressed in CHO cells by [3H]-Spiperone displacement.


Bioorg Med Chem Lett 12: 633-6 (2002)


BindingDB Entry DOI: 10.7270/Q2JM2B5X
More data for this
Ligand-Target Pair
DRD1


(BOVINE)
BDBM50109947
PNG
(3-[4-(4-Chloro-phenyl)-piperazin-1-ylmethyl]-7-tri...)
Show SMILES C[Si](C)(C)c1cccc2c(CN3CCN(CC3)c3ccc(Cl)cc3)cnn12
Show InChI InChI=1S/C21H27ClN4Si/c1-27(2,3)21-6-4-5-20-17(15-23-26(20)21)16-24-11-13-25(14-12-24)19-9-7-18(22)8-10-19/h4-10,15H,11-14,16H2,1-3H3
PDB

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7.10E+3n/an/an/an/an/an/an/an/a



Friedrich-Alexander University

Curated by ChEMBL


Assay Description
In vitro binding affinity at human cloned dopamine receptor D1 stably expressed in CHO cells by [3H]-SCH- 23390 displacement.


Bioorg Med Chem Lett 12: 633-6 (2002)


BindingDB Entry DOI: 10.7270/Q2JM2B5X
More data for this
Ligand-Target Pair