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BDBM50109946 3-[4-(4-Chloro-phenyl)-piperazin-1-ylmethyl]-2-methyl-7-phenyl-pyrazolo[1,5-a]pyridine::CHEMBL351550

SMILES: Cc1nn2c(cccc2c1CN1CCN(CC1)c1ccc(Cl)cc1)-c1ccccc1

InChI Key: InChIKey=JQBYEGVGELAAOI-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 = 50109946   
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))
BDBM50109946
PNG
(3-[4-(4-Chloro-phenyl)-piperazin-1-ylmethyl]-2-met...)
Show SMILES Cc1nn2c(cccc2c1CN1CCN(CC1)c1ccc(Cl)cc1)-c1ccccc1
Show InChI InChI=1S/C25H25ClN4/c1-19-23(18-28-14-16-29(17-15-28)22-12-10-21(26)11-13-22)25-9-5-8-24(30(25)27-19)20-6-3-2-4-7-20/h2-13H,14-18H2,1H3
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37n/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))
BDBM50109946
PNG
(3-[4-(4-Chloro-phenyl)-piperazin-1-ylmethyl]-2-met...)
Show SMILES Cc1nn2c(cccc2c1CN1CCN(CC1)c1ccc(Cl)cc1)-c1ccccc1
Show InChI InChI=1S/C25H25ClN4/c1-19-23(18-28-14-16-29(17-15-28)22-12-10-21(26)11-13-22)25-9-5-8-24(30(25)27-19)20-6-3-2-4-7-20/h2-13H,14-18H2,1H3
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 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
DRD1


(BOVINE)
BDBM50109946
PNG
(3-[4-(4-Chloro-phenyl)-piperazin-1-ylmethyl]-2-met...)
Show SMILES Cc1nn2c(cccc2c1CN1CCN(CC1)c1ccc(Cl)cc1)-c1ccccc1
Show InChI InChI=1S/C25H25ClN4/c1-19-23(18-28-14-16-29(17-15-28)22-12-10-21(26)11-13-22)25-9-5-8-24(30(25)27-19)20-6-3-2-4-7-20/h2-13H,14-18H2,1H3
PDB

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3.30E+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
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50109946
PNG
(3-[4-(4-Chloro-phenyl)-piperazin-1-ylmethyl]-2-met...)
Show SMILES Cc1nn2c(cccc2c1CN1CCN(CC1)c1ccc(Cl)cc1)-c1ccccc1
Show InChI InChI=1S/C25H25ClN4/c1-19-23(18-28-14-16-29(17-15-28)22-12-10-21(26)11-13-22)25-9-5-8-24(30(25)27-19)20-6-3-2-4-7-20/h2-13H,14-18H2,1H3
PDB

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2.40E+4n/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 (short) 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))
BDBM50109946
PNG
(3-[4-(4-Chloro-phenyl)-piperazin-1-ylmethyl]-2-met...)
Show SMILES Cc1nn2c(cccc2c1CN1CCN(CC1)c1ccc(Cl)cc1)-c1ccccc1
Show InChI InChI=1S/C25H25ClN4/c1-19-23(18-28-14-16-29(17-15-28)22-12-10-21(26)11-13-22)25-9-5-8-24(30(25)27-19)20-6-3-2-4-7-20/h2-13H,14-18H2,1H3
PDB

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PubMed
2.80E+4n/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