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BDBM293317 US10106504, Example 54

SMILES: Cc1nc(C)c(-c2ccc3CN(CCc3c2)c2ncnc3n(C)ncc23)c(-c2ccc3OCCCc3c2)c1[C@H](OC(C)(C)C)C(O)=O

InChI Key: InChIKey=KLJFQCHUATUTKW-XIFFEERXSA-N

Data: 2 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 293317   
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)
BDBM293317
PNG
(US10106504, Example 54)
Show SMILES Cc1nc(C)c(-c2ccc3CN(CCc3c2)c2ncnc3n(C)ncc23)c(-c2ccc3OCCCc3c2)c1[C@H](OC(C)(C)C)C(O)=O |r|
Show InChI InChI=1S/C37H40N6O4/c1-21-30(25-9-10-27-19-43(14-13-23(27)16-25)35-28-18-40-42(6)34(28)38-20-39-35)32(26-11-12-29-24(17-26)8-7-15-46-29)31(22(2)41-21)33(36(44)45)47-37(3,4)5/h9-12,16-18,20,33H,7-8,13-15,19H2,1-6H3,(H,44,45)/t33-/m0/s1
PDB

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 8n/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
HIV-1 Protease Chain A


(Human immunodeficiency virus type 1)
BDBM293317
PNG
(US10106504, Example 54)
Show SMILES Cc1nc(C)c(-c2ccc3CN(CCc3c2)c2ncnc3n(C)ncc23)c(-c2ccc3OCCCc3c2)c1[C@H](OC(C)(C)C)C(O)=O |r|
Show InChI InChI=1S/C37H40N6O4/c1-21-30(25-9-10-27-19-43(14-13-23(27)16-25)35-28-18-40-42(6)34(28)38-20-39-35)32(26-11-12-29-24(17-26)8-7-15-46-29)31(22(2)41-21)33(36(44)45)47-37(3,4)5/h9-12,16-18,20,33H,7-8,13-15,19H2,1-6H3,(H,44,45)/t33-/m0/s1
PDB

GoogleScholar
AffyNet 
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