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BDBM50064188 (2S,6R,11S)-6,11-Dimethyl-3-(2-morpholin-4-yl-ethyl)-1,2,3,4,5,6-hexahydro-2,6-methano-benzo[d]azocin-8-ol::CHEMBL288285

SMILES: C[C@@H]1[C@@H]2Cc3ccc(O)cc3[C@]1(C)CCN2CCN1CCOCC1

InChI Key: InChIKey=GKIYTUZZUSXSMR-UIAACRFSSA-N

Data: 3 KI

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50064188   
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
Sigma non-opioid intracellular receptor 1


(Homo sapiens (Human))
BDBM50064188
PNG
((2S,6R,11S)-6,11-Dimethyl-3-(2-morpholin-4-yl-ethy...)
Show SMILES C[C@@H]1[C@@H]2Cc3ccc(O)cc3[C@]1(C)CCN2CCN1CCOCC1 |TLB:16:15:1:10.4.3|
Show InChI InChI=1S/C20H30N2O2/c1-15-19-13-16-3-4-17(23)14-18(16)20(15,2)5-6-22(19)8-7-21-9-11-24-12-10-21/h3-4,14-15,19,23H,5-13H2,1-2H3/t15-,19+,20-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
13n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Inhibition of [3H]pentazocine binding to sigma-1 sites in guinea pig brain membranes


J Med Chem 41: 1574-80 (1998)


Article DOI: 10.1021/jm970333f
BindingDB Entry DOI: 10.7270/Q2C24X3R
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(RAT)
BDBM50064188
PNG
((2S,6R,11S)-6,11-Dimethyl-3-(2-morpholin-4-yl-ethy...)
Show SMILES C[C@@H]1[C@@H]2Cc3ccc(O)cc3[C@]1(C)CCN2CCN1CCOCC1 |TLB:16:15:1:10.4.3|
Show InChI InChI=1S/C20H30N2O2/c1-15-19-13-16-3-4-17(23)14-18(16)20(15,2)5-6-22(19)8-7-21-9-11-24-12-10-21/h3-4,14-15,19,23H,5-13H2,1-2H3/t15-,19+,20-/m1/s1
PDB

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KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
419n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Inhibition of [3H]N-methylscopolamine binding to Muscarinic acetylcholine receptor M2 of rat heart membranes


J Med Chem 41: 1574-80 (1998)


Article DOI: 10.1021/jm970333f
BindingDB Entry DOI: 10.7270/Q2C24X3R
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50064188
PNG
((2S,6R,11S)-6,11-Dimethyl-3-(2-morpholin-4-yl-ethy...)
Show SMILES C[C@@H]1[C@@H]2Cc3ccc(O)cc3[C@]1(C)CCN2CCN1CCOCC1 |TLB:16:15:1:10.4.3|
Show InChI InChI=1S/C20H30N2O2/c1-15-19-13-16-3-4-17(23)14-18(16)20(15,2)5-6-22(19)8-7-21-9-11-24-12-10-21/h3-4,14-15,19,23H,5-13H2,1-2H3/t15-,19+,20-/m1/s1
PDB

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KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Inhibition of [3H]spiroperidol binding to Dopamine receptor D2 of rat striatal membranes


J Med Chem 41: 1574-80 (1998)


Article DOI: 10.1021/jm970333f
BindingDB Entry DOI: 10.7270/Q2C24X3R
More data for this
Ligand-Target Pair