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BDBM50106315 3-(2-Benzhydryloxy-ethylidene)-8-methyl-8-aza-bicyclo[3.2.1]octane::CHEMBL130643

SMILES: CN1C2CCC1CC(C2)=CCOC(c1ccccc1)c1ccccc1

InChI Key: InChIKey=FDHDGKBELYFWPD-UHFFFAOYNA-N

Data: 3 KI

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 3 hits for monomerid = 50106315   
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


(RAT)
BDBM50106315
PNG
(3-(2-Benzhydryloxy-ethylidene)-8-methyl-8-aza-bicy...)
Show SMILES CN1C2CCC1CC(C2)=CCOC(c1ccccc1)c1ccccc1
Show InChI InChI=1/C23H27NO/c1-24-21-12-13-22(24)17-18(16-21)14-15-25-23(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-11,14,21-23H,12-13,15-17H2,1H3
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UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

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Similars

Article
PubMed
94n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by ChEMBL


Assay Description
Binding affinity against Muscarinic receptor from rat brain membranes using [3H]pirenzepine


J Med Chem 44: 3937-45 (2001)


Article DOI: 10.1021/jm0101592
BindingDB Entry DOI: 10.7270/Q26Q1XZT
More data for this
Ligand-Target Pair
Monoamine transporters; Norepininephrine & dopamine


(Rattus norvegicus (rat))
BDBM50106315
PNG
(3-(2-Benzhydryloxy-ethylidene)-8-methyl-8-aza-bicy...)
Show SMILES CN1C2CCC1CC(C2)=CCOC(c1ccccc1)c1ccccc1
Show InChI InChI=1/C23H27NO/c1-24-21-12-13-22(24)17-18(16-21)14-15-25-23(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-11,14,21-23H,12-13,15-17H2,1H3
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
130n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by ChEMBL


Assay Description
Binding affinity against Dopamine transporter using [125]RTI-55


J Med Chem 44: 3937-45 (2001)


Article DOI: 10.1021/jm0101592
BindingDB Entry DOI: 10.7270/Q26Q1XZT
More data for this
Ligand-Target Pair
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM50106315
PNG
(3-(2-Benzhydryloxy-ethylidene)-8-methyl-8-aza-bicy...)
Show SMILES CN1C2CCC1CC(C2)=CCOC(c1ccccc1)c1ccccc1
Show InChI InChI=1/C23H27NO/c1-24-21-12-13-22(24)17-18(16-21)14-15-25-23(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-11,14,21-23H,12-13,15-17H2,1H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
8.30E+3n/an/an/an/an/an/an/an/a



National Institute of Diabetes and Digestive and Kidney Diseases

Curated by ChEMBL


Assay Description
Binding affinity against serotonin transporter using [125]RTI-55


J Med Chem 44: 3937-45 (2001)


Article DOI: 10.1021/jm0101592
BindingDB Entry DOI: 10.7270/Q26Q1XZT
More data for this
Ligand-Target Pair