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BDBM50229173 CHEMBL355597

SMILES: [H][C@]12CCN3CCc4cc5OCOc5cc4[C@]3([H])[C@]1([H])CCCN2S(C)(=O)=O

InChI Key: InChIKey=XBMKQYCFWOWIGM-XUWXXGDYSA-N

Data: 2 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50229173   
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
Adrenergic receptor alpha-2


(RAT-NEONATAL RAT-Rattus norvegicus (rat))
BDBM50229173
PNG
(CHEMBL355597)
Show SMILES CS(=O)(=O)N1CCC[C@@H]2[C@@H]1CCN1CCc3cc4OCOc4cc3[C@H]21
Show InChI InChI=1S/C18H24N2O4S/c1-25(21,22)20-6-2-3-13-15(20)5-8-19-7-4-12-9-16-17(24-11-23-16)10-14(12)18(13)19/h9-10,13,15,18H,2-8,11H2,1H3/t13-,15+,18+/m1/s1
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
398n/an/an/an/an/an/an/an/a



Syntex Research

Curated by ChEMBL


Assay Description
Binding affinity to alpha-2 adrenergic receptor determined by measurement of [3H]yohimbine displacement from rat cortical membrane


J Med Chem 34: 705-17 (1991)


Article DOI: 10.1021/jm00106a036
More data for this
Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))
BDBM50229173
PNG
(CHEMBL355597)
Show SMILES CS(=O)(=O)N1CCC[C@@H]2[C@@H]1CCN1CCc3cc4OCOc4cc3[C@H]21
Show InChI InChI=1S/C18H24N2O4S/c1-25(21,22)20-6-2-3-13-15(20)5-8-19-7-4-12-9-16-17(24-11-23-16)10-14(12)18(13)19/h9-10,13,15,18H,2-8,11H2,1H3/t13-,15+,18+/m1/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
8.71E+3n/an/an/an/an/an/an/an/a



Syntex Research

Curated by ChEMBL


Assay Description
Binding affinity to alpha-1 adrenergic receptor determined by measurement of [3H]prazosin displacement from rat cortical membrane


J Med Chem 34: 705-17 (1991)


Article DOI: 10.1021/jm00106a036
More data for this
Ligand-Target Pair