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SMILES: COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2cnc(C)cn2)nnc1-c1ccco1

InChI Key: InChIKey=NYPCIVPLEXLOQZ-HNNXBMFYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 456595   
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))		BDBM456595
PNG
(US10736883, Example 32.0)
Show SMILES COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2cnc(C)cn2)nnc1-c1ccco1 |r,wU:16.17,(-6.08,-5.53,;-4.59,-5.93,;-3.5,-4.84,;-3.9,-3.35,;-2.81,-2.27,;-1.33,-2.66,;-.93,-4.15,;.56,-4.55,;1.65,-3.46,;-2.02,-5.24,;-1.51,-7.23,;-.18,-8,;1.16,-7.23,;2.49,-8,;1.72,-9.34,;3.83,-8.77,;3.26,-6.67,;2.49,-5.34,;4.8,-6.67,;5.57,-5.34,;7.11,-5.34,;7.88,-4,;7.11,-2.67,;7.88,-1.34,;5.57,-2.67,;4.8,-4,;-.5,-9.51,;-2.03,-9.67,;-2.65,-8.26,;-4.14,-7.87,;-4.84,-6.49,;-6.36,-6.73,;-6.6,-8.26,;-5.23,-8.95,)|
Show InChI InChI=1S/C22H24N6O5S/c1-14-12-24-16(13-23-14)11-15(2)34(29,30)27-22-26-25-21(19-9-6-10-33-19)28(22)20-17(31-3)7-5-8-18(20)32-4/h5-10,12-13,15H,11H2,1-4H3,(H,26,27)/t15-/m0/s1
PDB

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US Patent
n/an/an/an/a 2.30n/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