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SMILES: [Cl-].C[N+](C)(C)CC#CCOC(=O)Nc1ccc(Cl)cc1

InChI Key: InChIKey=ZIYPLFGQPKLCIR-UHFFFAOYSA-O

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 = 50475675   
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


(Homo sapiens (Human))
BDBM50475675
PNG
(CHEMBL380759)
Show SMILES [Cl-].C[N+](C)(C)CC#CCOC(=O)Nc1ccc(Cl)cc1
Show InChI InChI=1S/C14H17ClN2O2/c1-17(2,3)10-4-5-11-19-14(18)16-13-8-6-12(15)7-9-13/h6-9H,10-11H2,1-3H3/p+1
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
1.95E+3n/an/an/an/an/an/an/an/a



Universit£ di Firenze

Curated by ChEMBL


Assay Description
Binding affinity to cloned human muscarinic M1 receptor expressed in CHO cells


J Med Chem 49: 1925-31 (2006)


Article DOI: 10.1021/jm0510878
BindingDB Entry DOI: 10.7270/Q2HX1GFK
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50475675
PNG
(CHEMBL380759)
Show SMILES [Cl-].C[N+](C)(C)CC#CCOC(=O)Nc1ccc(Cl)cc1
Show InChI InChI=1S/C14H17ClN2O2/c1-17(2,3)10-4-5-11-19-14(18)16-13-8-6-12(15)7-9-13/h6-9H,10-11H2,1-3H3/p+1
PDB

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KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
Article
PubMed
2.40E+3n/an/an/an/an/an/an/an/a



Universit£ di Firenze

Curated by ChEMBL


Assay Description
Binding affinity to cloned human muscarinic M3 receptor expressed in CHO cells


J Med Chem 49: 1925-31 (2006)


Article DOI: 10.1021/jm0510878
BindingDB Entry DOI: 10.7270/Q2HX1GFK
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50475675
PNG
(CHEMBL380759)
Show SMILES [Cl-].C[N+](C)(C)CC#CCOC(=O)Nc1ccc(Cl)cc1
Show InChI InChI=1S/C14H17ClN2O2/c1-17(2,3)10-4-5-11-19-14(18)16-13-8-6-12(15)7-9-13/h6-9H,10-11H2,1-3H3/p+1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
3.24E+3n/an/an/an/an/an/an/an/a



Universit£ di Firenze

Curated by ChEMBL


Assay Description
Binding affinity to cloned human muscarinic M2 receptor expressed in CHO cells


J Med Chem 49: 1925-31 (2006)


Article DOI: 10.1021/jm0510878
BindingDB Entry DOI: 10.7270/Q2HX1GFK
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M5


(Homo sapiens (Human))
BDBM50475675
PNG
(CHEMBL380759)
Show SMILES [Cl-].C[N+](C)(C)CC#CCOC(=O)Nc1ccc(Cl)cc1
Show InChI InChI=1S/C14H17ClN2O2/c1-17(2,3)10-4-5-11-19-14(18)16-13-8-6-12(15)7-9-13/h6-9H,10-11H2,1-3H3/p+1
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PC sid
UniChem
Article
PubMed
3.80E+3n/an/an/an/an/an/an/an/a



Universit£ di Firenze

Curated by ChEMBL


Assay Description
Binding affinity to cloned human muscarinic M5 receptor expressed in CHO cells


J Med Chem 49: 1925-31 (2006)


Article DOI: 10.1021/jm0510878
BindingDB Entry DOI: 10.7270/Q2HX1GFK
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M4


(Homo sapiens (Human))
BDBM50475675
PNG
(CHEMBL380759)
Show SMILES [Cl-].C[N+](C)(C)CC#CCOC(=O)Nc1ccc(Cl)cc1
Show InChI InChI=1S/C14H17ClN2O2/c1-17(2,3)10-4-5-11-19-14(18)16-13-8-6-12(15)7-9-13/h6-9H,10-11H2,1-3H3/p+1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
9.12E+3n/an/an/an/an/an/an/an/a



Universit£ di Firenze

Curated by ChEMBL


Assay Description
Binding affinity to cloned human muscarinic M4 receptor expressed in CHO cells


J Med Chem 49: 1925-31 (2006)


Article DOI: 10.1021/jm0510878
BindingDB Entry DOI: 10.7270/Q2HX1GFK
More data for this
Ligand-Target Pair