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BDBM50225521 CHEMBL154882

SMILES: COc1cc2nc(nc(N)c2cc1OC)N1CCN(CC1)C(=O)C1COc2ccc(cc2O1)C(C)=O

InChI Key: InChIKey=MQOYDXBZVVBTKL-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50225521   
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-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor


(Rattus norvegicus (rat)-Rattus norvegicus (Rat))		BDBM50225521
PNG
(CHEMBL154882)
Show SMILES COc1cc2nc(nc(N)c2cc1OC)N1CCN(CC1)C(=O)C1COc2ccc(cc2O1)C(C)=O
Show InChI InChI=1S/C25H27N5O6/c1-14(31)15-4-5-18-21(10-15)36-22(13-35-18)24(32)29-6-8-30(9-7-29)25-27-17-12-20(34-3)19(33-2)11-16(17)23(26)28-25/h4-5,10-12,22H,6-9,13H2,1-3H3,(H2,26,27,28)
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Similars
PubMed
 3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Compound was tested for its binding affinity for alpha-1 adrenergic receptor site by displacement of [3H]clonidine at 10e-6 M concentration

J Med Chem 30: 49-57 (1987)


BindingDB Entry DOI: 10.7270/Q24J0HCH
More data for this
Ligand-Target Pair