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BDBM50175941 8-((cis, rac)-2-hydroxy-2-pyridin-3-yl-cyclohexyl)-1-phenyl-1,3,8-triaza-spiro[4.5]decan-4-one::CHEMBL200695

SMILES: O[C@]1(CCCC[C@H]1N1CCC2(CC1)N(CNC2=O)c1ccccc1)c1cccnc1

InChI Key: InChIKey=DQALBJZNLDLJRD-ZJSXRUAMSA-N

Data: 2 IC50  1 EC50

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 = 50175941   
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
Glycine transporter 1


(Homo sapiens (Human))
BDBM50175941
PNG
(8-((cis, rac)-2-hydroxy-2-pyridin-3-yl-cyclohexyl)...)
Show SMILES O[C@]1(CCCC[C@H]1N1CCC2(CC1)N(CNC2=O)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C24H30N4O2/c29-22-23(28(18-26-22)20-8-2-1-3-9-20)12-15-27(16-13-23)21-10-4-5-11-24(21,30)19-7-6-14-25-17-19/h1-3,6-9,14,17,21,30H,4-5,10-13,15-16,18H2,(H,26,29)/t21-,24-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 110n/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]glycine from human GlyT1 by radiometric assay


Bioorg Med Chem Lett 16: 354-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.09.067
BindingDB Entry DOI: 10.7270/Q2P26XPX
More data for this
Ligand-Target Pair
Nociceptin receptor


(Homo sapiens (Human))
BDBM50175941
PNG
(8-((cis, rac)-2-hydroxy-2-pyridin-3-yl-cyclohexyl)...)
Show SMILES O[C@]1(CCCC[C@H]1N1CCC2(CC1)N(CNC2=O)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C24H30N4O2/c29-22-23(28(18-26-22)20-8-2-1-3-9-20)12-15-27(16-13-23)21-10-4-5-11-24(21,30)19-7-6-14-25-17-19/h1-3,6-9,14,17,21,30H,4-5,10-13,15-16,18H2,(H,26,29)/t21-,24-/m1/s1
PDB

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KEGG

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Article
PubMed
n/an/a 1.34E+4n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]NOP from human NOP receptor expressed in HEK293 cells


Bioorg Med Chem Lett 16: 354-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.09.067
BindingDB Entry DOI: 10.7270/Q2P26XPX
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50175941
PNG
(8-((cis, rac)-2-hydroxy-2-pyridin-3-yl-cyclohexyl)...)
Show SMILES O[C@]1(CCCC[C@H]1N1CCC2(CC1)N(CNC2=O)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C24H30N4O2/c29-22-23(28(18-26-22)20-8-2-1-3-9-20)12-15-27(16-13-23)21-10-4-5-11-24(21,30)19-7-6-14-25-17-19/h1-3,6-9,14,17,21,30H,4-5,10-13,15-16,18H2,(H,26,29)/t21-,24-/m1/s1
PDB

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Reactome pathway
KEGG

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antibodypedia
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.80E+3n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Inhibitory activity at human mu opioid receptor in BHK cells by GTPgammaS binding assay


Bioorg Med Chem Lett 16: 354-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.09.067
BindingDB Entry DOI: 10.7270/Q2P26XPX
More data for this
Ligand-Target Pair