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SMILES: Oc1c2C(=O)N3[C@@H]4CC[C@@H](C4)O[C@@H]3Cn2cc(C(=O)NCc2ccc(F)cc2F)c1=O

InChI Key: InChIKey=YBYOYSBHGOPJMG-DVOMOZLQSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 335482   
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
Solute carrier family 22 member 2


(Homo sapiens (Human))		BDBM335482
PNG
(US9732092, Compound 3)
Show SMILES Oc1c2C(=O)N3[C@@H]4CC[C@@H](C4)O[C@@H]3Cn2cc(C(=O)NCc2ccc(F)cc2F)c1=O |r|
Show InChI InChI=1S/C21H19F2N3O5/c22-11-2-1-10(15(23)5-11)7-24-20(29)14-8-25-9-16-26(12-3-4-13(6-12)31-16)21(30)17(25)19(28)18(14)27/h1-2,5,8,12-13,16,28H,3-4,6-7,9H2,(H,24,29)/t12-,13+,16-/m1/s1
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PC cid
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US Patent
n/an/a 250n/an/an/an/an/an/a



Gilead Sciences, Inc.

US Patent


Assay Description
Test compounds were serially diluted in DMSO and then spiked (2 μL) into in 0.4 mL KHB buffer containing wild-type or OCT2-transfected cells and...

US Patent US9732092 (2017)


BindingDB Entry DOI: 10.7270/Q2SN0C2R
More data for this
Ligand-Target Pair