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SMILES: C[C@@H]1CCCN(C1)C1CCN(CC1)C(=O)c1cnc(nc1)N1CC2(COC2)C1

InChI Key: InChIKey=KLDQMJZLZCRHII-MRXNPFEDSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 317608   
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))		BDBM317608
PNG
(US9624199, 18 | [(3R)-3-Methyl-1,4′-bipiperi...)
Show SMILES C[C@@H]1CCCN(C1)C1CCN(CC1)C(=O)c1cnc(nc1)N1CC2(COC2)C1 |r|
Show InChI InChI=1S/C21H31N5O2/c1-16-3-2-6-25(11-16)18-4-7-24(8-5-18)19(27)17-9-22-20(23-10-17)26-12-21(13-26)14-28-15-21/h9-10,16,18H,2-8,11-15H2,1H3/t16-/m1/s1
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US Patent
n/an/a 24n/an/an/an/an/an/a



Bayer Pharma Aktiengesellschaft

US Patent


Assay Description
To prepare cell membranes with human α1- and α2-adrenergic receptors, CHO cells stably overexpressing α1- and α2-adrenergic recep...

US Patent US9624199 (2017)


BindingDB Entry DOI: 10.7270/Q2ZG6VB7
More data for this
Ligand-Target Pair