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SMILES: COc1cccc(OC)c1-n1c(NS(=O)(=O)C(C)Cc2ncc(F)cn2)nnc1-c1cccnc1

InChI Key: InChIKey=BGTXYBUAMCBKGR-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 363104   
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))
BDBM363104
PNG
(N-(4-(2,6-dimethoxyphenyl)-5-(3-pyridinyl)-4H-1,2,...)
Show SMILES COc1cccc(OC)c1-n1c(NS(=O)(=O)C(C)Cc2ncc(F)cn2)nnc1-c1cccnc1 |(-7.16,-3.61,;-5.82,-4.38,;-4.49,-3.61,;-4.49,-2.07,;-3.16,-1.3,;-1.82,-2.07,;-1.82,-3.61,;-.49,-4.38,;.85,-3.61,;-3.16,-4.38,;-3.16,-5.92,;-1.91,-6.82,;-.58,-6.05,;.76,-6.82,;-.01,-8.16,;1.53,-8.16,;2.09,-6.05,;2.09,-4.51,;3.43,-6.82,;4.76,-6.05,;6.09,-6.82,;7.43,-6.05,;7.43,-4.51,;8.76,-3.74,;6.09,-3.74,;4.76,-4.51,;-2.39,-8.29,;-3.93,-8.29,;-4.4,-6.82,;-5.94,-6.82,;-6.71,-5.49,;-8.25,-5.49,;-9.02,-6.82,;-8.25,-8.16,;-6.71,-8.16,)|
Show InChI InChI=1S/C22H22FN7O4S/c1-14(10-19-25-12-16(23)13-26-19)35(31,32)29-22-28-27-21(15-6-5-9-24-11-15)30(22)20-17(33-2)7-4-8-18(20)34-3/h4-9,11-14H,10H2,1-3H3,(H,28,29)
PDB

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PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 6.40n/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 US9845310 (2017)


BindingDB Entry DOI: 10.7270/Q28P62TV
More data for this
Ligand-Target Pair