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SMILES: COC(=O)Oc1c(c(C)nc2cc(CO)c(Cl)cc12)-c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1

InChI Key: InChIKey=RYVLDKXEQPLLPA-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 434954   
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
Chloroquine resistance transporter


(Plasmodium falciparum)		BDBM434954
PNG
(US10584098, Code ELQ-336)
Show SMILES COC(=O)Oc1c(c(C)nc2cc(CO)c(Cl)cc12)-c1ccc(Oc2ccc(OC(F)(F)F)cc2)cc1
Show InChI InChI=1S/C26H19ClF3NO6/c1-14-23(24(36-25(33)34-2)20-12-21(27)16(13-32)11-22(20)31-14)15-3-5-17(6-4-15)35-18-7-9-19(10-8-18)37-26(28,29)30/h3-12,32H,13H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 2.5n/an/an/an/an/an/a



Oregon Health & Science University

US Patent


Assay Description
In vitro experiments show that the intrinsic antiplasmodial activity of ethylcarbonate ester ELQ-337 is indistinguishable from ELQ-300, with IC50 val...

US Patent US10584098 (2020)


BindingDB Entry DOI: 10.7270/Q2R213TH
More data for this
Ligand-Target Pair