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BDBM50074011 1'-[2-(1-naphthyl)ethyl]spiro[2,3-dihydro-1H-indene-2,4'-(hexahydropyridine)]-1-one::CHEMBL100052

SMILES: O=C1c2ccccc2CC11CCN(CCc2cccc3ccccc23)CC1

InChI Key: InChIKey=LXIPAAJKLDMQAA-UHFFFAOYSA-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 = 50074011   
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
Alpha-1A adrenergic receptor


(Homo sapiens (Human))
BDBM50074011
PNG
(1'-[2-(1-naphthyl)ethyl]spiro[2,3-dihydro-1H-inden...)
Show SMILES O=C1c2ccccc2CC11CCN(CCc2cccc3ccccc23)CC1
Show InChI InChI=1S/C25H25NO/c27-24-23-11-4-2-7-21(23)18-25(24)13-16-26(17-14-25)15-12-20-9-5-8-19-6-1-3-10-22(19)20/h1-11H,12-18H2
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
31n/an/an/an/an/an/an/an/a



Merck & Co.

Curated by ChEMBL


Assay Description
Displacement of [125I]-HEAT from human Alpha-1C adrenergic receptor expressed in CHO cells


Bioorg Med Chem Lett 9: 291-4 (1999)


BindingDB Entry DOI: 10.7270/Q20G3JBP
More data for this
Ligand-Target Pair
Adrenergic alpha1B


(Homo sapiens (Human))
BDBM50074011
PNG
(1'-[2-(1-naphthyl)ethyl]spiro[2,3-dihydro-1H-inden...)
Show SMILES O=C1c2ccccc2CC11CCN(CCc2cccc3ccccc23)CC1
Show InChI InChI=1S/C25H25NO/c27-24-23-11-4-2-7-21(23)18-25(24)13-16-26(17-14-25)15-12-20-9-5-8-19-6-1-3-10-22(19)20/h1-11H,12-18H2
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
49n/an/an/an/an/an/an/an/a



Merck & Co.

Curated by ChEMBL


Assay Description
Displacement of [125I]-HEAT from human Alpha-1B adrenergic receptor expressed in LM cells


Bioorg Med Chem Lett 9: 291-4 (1999)


BindingDB Entry DOI: 10.7270/Q20G3JBP
More data for this
Ligand-Target Pair
Alpha-1D adrenergic receptor


(Homo sapiens (Human))
BDBM50074011
PNG
(1'-[2-(1-naphthyl)ethyl]spiro[2,3-dihydro-1H-inden...)
Show SMILES O=C1c2ccccc2CC11CCN(CCc2cccc3ccccc23)CC1
Show InChI InChI=1S/C25H25NO/c27-24-23-11-4-2-7-21(23)18-25(24)13-16-26(17-14-25)15-12-20-9-5-8-19-6-1-3-10-22(19)20/h1-11H,12-18H2
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
149n/an/an/an/an/an/an/an/a



Merck & Co.

Curated by ChEMBL


Assay Description
Displacement of [125I]-HEAT from human Alpha-1D adrenergic receptor expressed in HEK cells


Bioorg Med Chem Lett 9: 291-4 (1999)


BindingDB Entry DOI: 10.7270/Q20G3JBP
More data for this
Ligand-Target Pair