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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Muscarinic acetylcholine receptor M2' and Ligand = 'BDBM50165016'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Muscarinic acetylcholine receptor M2


(RAT)
BDBM50165016
PNG
(4-Methyl-2-[3-((1R,5S)-2-methyl-3-aza-bicyclo[3.1....)
Show SMILES CC1[C@@H]2C[C@@H]2CN1CCC(c1ccccc1)c1cc(C)ccc1O
Show InChI InChI=1S/C22H27NO/c1-15-8-9-22(24)21(12-15)19(17-6-4-3-5-7-17)10-11-23-14-18-13-20(18)16(23)2/h3-9,12,16,18-20,24H,10-11,13-14H2,1-2H3/t16?,18-,19?,20+/m1/s1
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PC cid
PC sid
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Similars

Article
PubMed
34n/an/an/an/an/an/an/an/a



Ranbaxy Research Laboratories

Curated by ChEMBL


Assay Description
Affinity for rat Muscarinic acetylcholine receptor M2


Bioorg Med Chem Lett 15: 2093-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.036
BindingDB Entry DOI: 10.7270/Q2DJ5F4X
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(RAT)
BDBM50165016
PNG
(4-Methyl-2-[3-((1R,5S)-2-methyl-3-aza-bicyclo[3.1....)
Show SMILES CC1[C@@H]2C[C@@H]2CN1CCC(c1ccccc1)c1cc(C)ccc1O
Show InChI InChI=1S/C22H27NO/c1-15-8-9-22(24)21(12-15)19(17-6-4-3-5-7-17)10-11-23-14-18-13-20(18)16(23)2/h3-9,12,16,18-20,24H,10-11,13-14H2,1-2H3/t16?,18-,19?,20+/m1/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
34n/an/an/an/an/an/an/an/a



Ranbaxy Research Laboratories

Curated by ChEMBL


Assay Description
Affinity for rat Muscarinic acetylcholine receptor M2


Bioorg Med Chem Lett 15: 2093-6 (2005)


Article DOI: 10.1016/j.bmcl.2005.02.036
BindingDB Entry DOI: 10.7270/Q2DJ5F4X
More data for this
Ligand-Target Pair