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BDBM293280 US10106504, Example 17

SMILES: CCOCCOCc1nc(C)c([C@H](OC(C)(C)C)C(O)=O)c(-c2ccc3OCCCc3c2)c1-c1ccc(OCCc2ccc(F)cc2)cc1

InChI Key: InChIKey=CCTAHJHBWYTVNF-LHEWISCISA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 293280   
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
HIV-1 Protease Chain A


(Human immunodeficiency virus type 1)		BDBM293280
PNG
(US10106504, Example 17)
Show SMILES CCOCCOCc1nc(C)c([C@H](OC(C)(C)C)C(O)=O)c(-c2ccc3OCCCc3c2)c1-c1ccc(OCCc2ccc(F)cc2)cc1 |r|
Show InChI InChI=1S/C40H46FNO7/c1-6-45-22-23-46-25-33-36(28-11-16-32(17-12-28)47-21-19-27-9-14-31(41)15-10-27)37(30-13-18-34-29(24-30)8-7-20-48-34)35(26(2)42-33)38(39(43)44)49-40(3,4)5/h9-18,24,38H,6-8,19-23,25H2,1-5H3,(H,43,44)/t38-/m0/s1
PDB

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PC cid
PC sid
UniChem
US Patent
n/an/an/an/a<100n/an/a7.55n/a



ViiV HEALTHCARE UK (NO.5) LIMITED

US Patent


Assay Description
A recombinant NL-RLuc proviral clone was constructed in which a section of the nef gene from NL4-3 was replaced with the Renilla Luciferase gene. Thi...

US Patent US10106504 (2018)


BindingDB Entry DOI: 10.7270/Q2BC41K2
More data for this
Ligand-Target Pair