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BDBM50229615 CHEMBL81314

SMILES: [H][C@@]12CC[N@@](C[C@@H]1n1ncnn1)C2

InChI Key: InChIKey=XZMQFEJLFZMSPD-BQBZGAKWSA-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 = 50229615   
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


(RAT)
BDBM50229615
PNG
(CHEMBL81314)
Show SMILES [H][C@@]12CC[N@@](C[C@@H]1n1ncnn1)C2
Show InChI InChI=1S/C7H11N5/c1-2-11-3-6(1)7(4-11)12-9-5-8-10-12/h5-7H,1-4H2/t6-,7-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 30n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro ability to displace [3H]oxotremorine-M (OXO-M) from rat cerebral cortex muscarinic receptor.


J Med Chem 35: 2392-406 (1992)


BindingDB Entry DOI: 10.7270/Q2TF00K5
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50229615
PNG
(CHEMBL81314)
Show SMILES [H][C@@]12CC[N@@](C[C@@H]1n1ncnn1)C2
Show InChI InChI=1S/C7H11N5/c1-2-11-3-6(1)7(4-11)12-9-5-8-10-12/h5-7H,1-4H2/t6-,7-/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 1.43E+4n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro displacement of [3H]quinuclidinyl benzilate (QNB) from rat cerebral cortex muscarinic receptor.


J Med Chem 35: 2392-406 (1992)


BindingDB Entry DOI: 10.7270/Q2TF00K5
More data for this
Ligand-Target Pair