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BDBM50263370 1-(1'-(2-(trifluoromethyl)benzyl)-1,4'-bipiperidin-4-yl)-1H-benzo[d]imidazol-2(3H)-one::1-[1'-(2-Trifluoromethyl-benzyl)-[1,4']bipiperidinyl-4-yl]-1,3-dihydro-benzoimidazol-2-one::CHEMBL478662

SMILES: FC(F)(F)c1ccccc1CN1CCC(CC1)N1CCC(CC1)n1c2ccccc2[nH]c1=O

InChI Key: InChIKey=UKCKRTPVYWRRHT-UHFFFAOYSA-N

Data: 6 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 = 50263370   
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 M1/M5 chimeric protein


(Homo sapiens (Human))
BDBM50263370
PNG
(1-(1'-(2-(trifluoromethyl)benzyl)-1,4'-bipiperidin...)
Show SMILES FC(F)(F)c1ccccc1CN1CCC(CC1)N1CCC(CC1)n1c2ccccc2[nH]c1=O
Show InChI InChI=1S/C25H29F3N4O/c26-25(27,28)21-6-2-1-5-18(21)17-30-13-9-19(10-14-30)31-15-11-20(12-16-31)32-23-8-4-3-7-22(23)29-24(32)33/h1-8,19-20H,9-17H2,(H,29,33)
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Article
PubMed
n/an/an/an/a>5.00E+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: 5439-42 (2008)


Article DOI: 10.1016/j.bmcl.2008.09.023
BindingDB Entry DOI: 10.7270/Q2708198
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50263370
PNG
(1-(1'-(2-(trifluoromethyl)benzyl)-1,4'-bipiperidin...)
Show SMILES FC(F)(F)c1ccccc1CN1CCC(CC1)N1CCC(CC1)n1c2ccccc2[nH]c1=O
Show InChI InChI=1S/C25H29F3N4O/c26-25(27,28)21-6-2-1-5-18(21)17-30-13-9-19(10-14-30)31-15-11-20(12-16-31)32-23-8-4-3-7-22(23)29-24(32)33/h1-8,19-20H,9-17H2,(H,29,33)
PDB

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Patents


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Article
PubMed
n/an/an/an/a>5.00E+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: 5439-42 (2008)


Article DOI: 10.1016/j.bmcl.2008.09.023
BindingDB Entry DOI: 10.7270/Q2708198
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50263370
PNG
(1-(1'-(2-(trifluoromethyl)benzyl)-1,4'-bipiperidin...)
Show SMILES FC(F)(F)c1ccccc1CN1CCC(CC1)N1CCC(CC1)n1c2ccccc2[nH]c1=O
Show InChI InChI=1S/C25H29F3N4O/c26-25(27,28)21-6-2-1-5-18(21)17-30-13-9-19(10-14-30)31-15-11-20(12-16-31)32-23-8-4-3-7-22(23)29-24(32)33/h1-8,19-20H,9-17H2,(H,29,33)
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 334n/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 M4


(Homo sapiens (Human))
BDBM50263370
PNG
(1-(1'-(2-(trifluoromethyl)benzyl)-1,4'-bipiperidin...)
Show SMILES FC(F)(F)c1ccccc1CN1CCC(CC1)N1CCC(CC1)n1c2ccccc2[nH]c1=O
Show InChI InChI=1S/C25H29F3N4O/c26-25(27,28)21-6-2-1-5-18(21)17-30-13-9-19(10-14-30)31-15-11-20(12-16-31)32-23-8-4-3-7-22(23)29-24(32)33/h1-8,19-20H,9-17H2,(H,29,33)
Reactome pathway
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Article
PubMed
n/an/an/an/a>5.00E+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: 5439-42 (2008)


Article DOI: 10.1016/j.bmcl.2008.09.023
BindingDB Entry DOI: 10.7270/Q2708198
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50263370
PNG
(1-(1'-(2-(trifluoromethyl)benzyl)-1,4'-bipiperidin...)
Show SMILES FC(F)(F)c1ccccc1CN1CCC(CC1)N1CCC(CC1)n1c2ccccc2[nH]c1=O
Show InChI InChI=1S/C25H29F3N4O/c26-25(27,28)21-6-2-1-5-18(21)17-30-13-9-19(10-14-30)31-15-11-20(12-16-31)32-23-8-4-3-7-22(23)29-24(32)33/h1-8,19-20H,9-17H2,(H,29,33)
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 410n/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: 5439-42 (2008)


Article DOI: 10.1016/j.bmcl.2008.09.023
BindingDB Entry DOI: 10.7270/Q2708198
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50263370
PNG
(1-(1'-(2-(trifluoromethyl)benzyl)-1,4'-bipiperidin...)
Show SMILES FC(F)(F)c1ccccc1CN1CCC(CC1)N1CCC(CC1)n1c2ccccc2[nH]c1=O
Show InChI InChI=1S/C25H29F3N4O/c26-25(27,28)21-6-2-1-5-18(21)17-30-13-9-19(10-14-30)31-15-11-20(12-16-31)32-23-8-4-3-7-22(23)29-24(32)33/h1-8,19-20H,9-17H2,(H,29,33)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a>5.00E+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: 5439-42 (2008)


Article DOI: 10.1016/j.bmcl.2008.09.023
BindingDB Entry DOI: 10.7270/Q2708198
More data for this
Ligand-Target Pair