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BDBM50223642 CHEMBL7821

SMILES: CN1CCN(CC1)C1=Cc2ccccc2Cc2ccccc12

InChI Key: InChIKey=CQBZYAFJUWYRHM-UHFFFAOYSA-N

Data: 4 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50223642   
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
Dopamine receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50223642
PNG
(CHEMBL7821)
Show SMILES CN1CCN(CC1)C1=Cc2ccccc2Cc2ccccc12 |t:8|
Show InChI InChI=1S/C20H22N2/c1-21-10-12-22(13-11-21)20-15-17-7-3-2-6-16(17)14-18-8-4-5-9-19(18)20/h2-9,15H,10-14H2,1H3
PDB
MMDB

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PC sid
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n/an/a 808n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of 3[H]spiroperidol from Dopamine receptor in rat brain


J Med Chem 25: 855-8 (1982)


BindingDB Entry DOI: 10.7270/Q2N018R2
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50223642
PNG
(CHEMBL7821)
Show SMILES CN1CCN(CC1)C1=Cc2ccccc2Cc2ccccc12 |t:8|
Show InChI InChI=1S/C20H22N2/c1-21-10-12-22(13-11-21)20-15-17-7-3-2-6-16(17)14-18-8-4-5-9-19(18)20/h2-9,15H,10-14H2,1H3
PDB
MMDB

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n/an/a 610n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Concentration required (in vitro) to displace 50% specific binding of [3H]clozapine to Muscarinic acetylcholine receptor in rat brain


J Med Chem 24: 1021-6 (1981)


BindingDB Entry DOI: 10.7270/Q2348NKF
More data for this
Ligand-Target Pair
Dopamine receptor


(Rattus norvegicus (rat)-RAT-Rattus norvegicus (Rat...)
BDBM50223642
PNG
(CHEMBL7821)
Show SMILES CN1CCN(CC1)C1=Cc2ccccc2Cc2ccccc12 |t:8|
Show InChI InChI=1S/C20H22N2/c1-21-10-12-22(13-11-21)20-15-17-7-3-2-6-16(17)14-18-8-4-5-9-19(18)20/h2-9,15H,10-14H2,1H3
PDB
MMDB

Reactome pathway
KEGG

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CHEMBL
PC cid
PC sid
UniChem

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PubMed
n/an/a 808n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Relative affinity for dopamine receptor by displacement of [3H]spiroperidol (2.2 nM) from (in vitro) dopamine binding sites in rat caudate nuclei


J Med Chem 24: 1021-6 (1981)


BindingDB Entry DOI: 10.7270/Q2348NKF
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50223642
PNG
(CHEMBL7821)
Show SMILES CN1CCN(CC1)C1=Cc2ccccc2Cc2ccccc12 |t:8|
Show InChI InChI=1S/C20H22N2/c1-21-10-12-22(13-11-21)20-15-17-7-3-2-6-16(17)14-18-8-4-5-9-19(18)20/h2-9,15H,10-14H2,1H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 610n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Tested in vitro for its ability to displace 3[H] clozapine from Muscarinic acetylcholine receptor in rat brain


J Med Chem 25: 855-8 (1982)


BindingDB Entry DOI: 10.7270/Q2N018R2
More data for this
Ligand-Target Pair