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SMILES: COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](O)c2coc(C)n2)nnc1-c1ccc(C)o1

InChI Key: InChIKey=ADQLQYLPPDRUCJ-RNODOKPDSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 456614   
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
Apelin receptor


(Homo sapiens (Human))		BDBM456614
PNG
(US10736883, Example 55.0)
Show SMILES COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@@H](O)c2coc(C)n2)nnc1-c1ccc(C)o1 |r,wU:16.17,wD:18.19,(1.03,6.78,;-.3,6.01,;-1.64,6.78,;-1.64,8.32,;-2.98,9.09,;-4.31,8.32,;-4.31,6.78,;-5.64,6.01,;-6.97,6.78,;-2.97,6.01,;-2.97,4.47,;-1.72,3.57,;-.39,4.34,;.94,3.57,;2.28,2.8,;-.39,2.8,;2.28,4.34,;2.28,5.88,;3.61,3.57,;3.61,2.03,;4.94,4.34,;5.11,5.87,;6.61,6.19,;7.38,4.85,;8.91,4.69,;6.35,3.71,;-2.2,2.1,;-3.74,2.1,;-4.22,3.56,;-5.68,4.04,;-6.16,5.5,;-7.7,5.5,;-8.17,4.04,;-9.64,3.56,;-6.93,3.13,)|
Show InChI InChI=1S/C22H25N5O7S/c1-12-9-10-18(34-12)21-24-25-22(27(21)19-16(31-4)7-6-8-17(19)32-5)26-35(29,30)13(2)20(28)15-11-33-14(3)23-15/h6-11,13,20,28H,1-5H3,(H,25,26)/t13-,20+/m0/s1
PDB

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US Patent
n/an/an/an/a 28n/an/an/an/a



AMGEN INC.

US Patent


Assay Description
The human APJ receptor was cloned by polymerase chain reaction and the gene encoding the receptor was subcloned in pFLAG-CMV-3 expression vector (Sig...

US Patent US10736883 (2020)


BindingDB Entry DOI: 10.7270/Q2JW8HXW
More data for this
Ligand-Target Pair