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BDBM50275502 4-fluoro-1-(1'-(phenylsulfonyl)-1,4'-bipiperidin-4-yl)-1H-benzo[d]imidazol-2(3H)-one::CHEMBL486758

SMILES: Fc1cccc2n(C3CCN(CC3)C3CCN(CC3)S(=O)(=O)c3ccccc3)c(=O)[nH]c12

InChI Key: InChIKey=SZMMDBAEOIFVNU-UHFFFAOYSA-N

Data: 1 IC50  5 EC50

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 6 hits for monomerid = 50275502   
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
Muscarinic acetylcholine receptor M5


(Homo sapiens (Human))
BDBM50275502
PNG
(4-fluoro-1-(1'-(phenylsulfonyl)-1,4'-bipiperidin-4...)
Show SMILES Fc1cccc2n(C3CCN(CC3)C3CCN(CC3)S(=O)(=O)c3ccccc3)c(=O)[nH]c12
Show InChI InChI=1S/C23H27FN4O3S/c24-20-7-4-8-21-22(20)25-23(29)28(21)18-9-13-26(14-10-18)17-11-15-27(16-12-17)32(30,31)19-5-2-1-3-6-19/h1-8,17-18H,9-16H2,(H,25,29)
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n/an/an/an/a>3.00E+4n/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Agonist activity at muscarinic M5 receptor (unknown origin)


Bioorg Med Chem Lett 18: 5443-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.09.032
BindingDB Entry DOI: 10.7270/Q29K4B1C
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50275502
PNG
(4-fluoro-1-(1'-(phenylsulfonyl)-1,4'-bipiperidin-4...)
Show SMILES Fc1cccc2n(C3CCN(CC3)C3CCN(CC3)S(=O)(=O)c3ccccc3)c(=O)[nH]c12
Show InChI InChI=1S/C23H27FN4O3S/c24-20-7-4-8-21-22(20)25-23(29)28(21)18-9-13-26(14-10-18)17-11-15-27(16-12-17)32(30,31)19-5-2-1-3-6-19/h1-8,17-18H,9-16H2,(H,25,29)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Antagonist activity at dopamine D2 receptor (unknown origin)


Bioorg Med Chem Lett 18: 5443-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.09.032
BindingDB Entry DOI: 10.7270/Q29K4B1C
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50275502
PNG
(4-fluoro-1-(1'-(phenylsulfonyl)-1,4'-bipiperidin-4...)
Show SMILES Fc1cccc2n(C3CCN(CC3)C3CCN(CC3)S(=O)(=O)c3ccccc3)c(=O)[nH]c12
Show InChI InChI=1S/C23H27FN4O3S/c24-20-7-4-8-21-22(20)25-23(29)28(21)18-9-13-26(14-10-18)17-11-15-27(16-12-17)32(30,31)19-5-2-1-3-6-19/h1-8,17-18H,9-16H2,(H,25,29)
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n/an/an/an/a 2.60E+3n/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Agonist activity at muscarinic M1 receptor (unknown origin)


Bioorg Med Chem Lett 18: 5443-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.09.032
BindingDB Entry DOI: 10.7270/Q29K4B1C
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50275502
PNG
(4-fluoro-1-(1'-(phenylsulfonyl)-1,4'-bipiperidin-4...)
Show SMILES Fc1cccc2n(C3CCN(CC3)C3CCN(CC3)S(=O)(=O)c3ccccc3)c(=O)[nH]c12
Show InChI InChI=1S/C23H27FN4O3S/c24-20-7-4-8-21-22(20)25-23(29)28(21)18-9-13-26(14-10-18)17-11-15-27(16-12-17)32(30,31)19-5-2-1-3-6-19/h1-8,17-18H,9-16H2,(H,25,29)
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n/an/an/an/a>3.00E+4n/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Agonist activity at muscarinic M3 receptor (unknown origin)


Bioorg Med Chem Lett 18: 5443-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.09.032
BindingDB Entry DOI: 10.7270/Q29K4B1C
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M4


(Homo sapiens (Human))
BDBM50275502
PNG
(4-fluoro-1-(1'-(phenylsulfonyl)-1,4'-bipiperidin-4...)
Show SMILES Fc1cccc2n(C3CCN(CC3)C3CCN(CC3)S(=O)(=O)c3ccccc3)c(=O)[nH]c12
Show InChI InChI=1S/C23H27FN4O3S/c24-20-7-4-8-21-22(20)25-23(29)28(21)18-9-13-26(14-10-18)17-11-15-27(16-12-17)32(30,31)19-5-2-1-3-6-19/h1-8,17-18H,9-16H2,(H,25,29)
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n/an/an/an/a>3.00E+4n/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Agonist activity at muscarinic M4 receptor (unknown origin)


Bioorg Med Chem Lett 18: 5443-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.09.032
BindingDB Entry DOI: 10.7270/Q29K4B1C
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50275502
PNG
(4-fluoro-1-(1'-(phenylsulfonyl)-1,4'-bipiperidin-4...)
Show SMILES Fc1cccc2n(C3CCN(CC3)C3CCN(CC3)S(=O)(=O)c3ccccc3)c(=O)[nH]c12
Show InChI InChI=1S/C23H27FN4O3S/c24-20-7-4-8-21-22(20)25-23(29)28(21)18-9-13-26(14-10-18)17-11-15-27(16-12-17)32(30,31)19-5-2-1-3-6-19/h1-8,17-18H,9-16H2,(H,25,29)
PDB

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PubMed
n/an/an/an/a>3.00E+4n/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Agonist activity at muscarinic M2 receptor (unknown origin)


Bioorg Med Chem Lett 18: 5443-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.09.032
BindingDB Entry DOI: 10.7270/Q29K4B1C
More data for this
Ligand-Target Pair