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BDBM50006575 5-[4-(Hexane-1-sulfonyl)-[1,2,5]thiadiazol-3-yl]-1-methyl-1,2,3,6-tetrahydro-pyridine::CHEMBL75704

SMILES: CCCCCCS(=O)(=O)c1nsnc1C1=CCCN(C)C1

InChI Key: InChIKey=BFUKGYHLEZMWPB-UHFFFAOYSA-N

Data: 2 IC50

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 2 hits for monomerid = 50006575   
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 receptor M1 and M2


(RAT)
BDBM50006575
PNG
(5-[4-(Hexane-1-sulfonyl)-[1,2,5]thiadiazol-3-yl]-1...)
Show SMILES CCCCCCS(=O)(=O)c1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C14H23N3O2S2/c1-3-4-5-6-10-21(18,19)14-13(15-20-16-14)12-8-7-9-17(2)11-12/h8H,3-7,9-11H2,1-2H3
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 29n/an/an/an/an/an/a



Novo Nordisk CNS Division

Curated by ChEMBL


Assay Description
In vitro binding affinity against muscarinic acetylcholine receptor M1 from rat hippocampus, using [3H]-pirenzepine (Pz) as radioligand


J Med Chem 35: 2274-83 (1992)


Article DOI: 10.1021/jm00090a019
BindingDB Entry DOI: 10.7270/Q22J69TH
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50006575
PNG
(5-[4-(Hexane-1-sulfonyl)-[1,2,5]thiadiazol-3-yl]-1...)
Show SMILES CCCCCCS(=O)(=O)c1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C14H23N3O2S2/c1-3-4-5-6-10-21(18,19)14-13(15-20-16-14)12-8-7-9-17(2)11-12/h8H,3-7,9-11H2,1-2H3
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 62n/an/an/an/an/an/a



Novo Nordisk CNS Division

Curated by ChEMBL


Assay Description
In vitro binding affinity against muscarinic acetylcholine receptor M1 from rat hippocampus, using [3H]-oxotremorine-M (Oxo-M) as radioligand


J Med Chem 35: 2274-83 (1992)


Article DOI: 10.1021/jm00090a019
BindingDB Entry DOI: 10.7270/Q22J69TH
More data for this
Ligand-Target Pair