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Patent code US10221156

Compile Data Set for Download or QSAR
Found 6 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Envelope glycoprotein gp160


(Human immunodeficiency virus type 1 (isolate BRU/L...)
BDBM359610
PNG
(US10221156, Example 5)
Show SMILES Cc1nc(C)c(-c2ccc(OCCN3CCOCC3)cc2)c(N2CCC(C)(C)CC2)c1[C@H](OC(C)(C)C)C(O)=O
Show InChI InChI=1S/C32H47N3O5/c1-22-26(24-8-10-25(11-9-24)39-21-18-34-16-19-38-20-17-34)28(35-14-12-32(6,7)13-15-35)27(23(2)33-22)29(30(36)37)40-31(3,4)5/h8-11,29H,12-21H2,1-7H3,(H,36,37)/t29-/m0/s1
PDB

UniProtKB/TrEMBL

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 21n/an/an/an/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 US10221156 (2019)

More data for this
Ligand-Target Pair
Envelope glycoprotein gp160


(Human immunodeficiency virus type 1 (isolate BRU/L...)
BDBM359609
PNG
(US10221156, Example 2)
Show SMILES Cc1nc(C)c(-c2ccc(OCCC3CCCCC3)cc2)c(N2CCC(C)(C)CC2)c1[C@H](OC(C)(C)C)C(O)=O
Show InChI InChI=1S/C34H50N2O4/c1-23-28(26-13-15-27(16-14-26)39-22-17-25-11-9-8-10-12-25)30(36-20-18-34(6,7)19-21-36)29(24(2)35-23)31(32(37)38)40-33(3,4)5/h13-16,25,31H,8-12,17-22H2,1-7H3,(H,37,38)/t31-/m0/s1
PDB

UniProtKB/TrEMBL

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 34n/an/an/an/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 US10221156 (2019)

More data for this
Ligand-Target Pair
Envelope glycoprotein gp160


(Human immunodeficiency virus type 1 (isolate BRU/L...)
BDBM359612
PNG
(US10221156, Example 13)
Show SMILES Cc1nc(C)c(-c2ccc(OCCN3CCSCC3)cc2)c(N2CCC(C)(C)CC2)c1[C@H](OC(C)(C)C)C(O)=O
Show InChI InChI=1S/C32H47N3O4S/c1-22-26(24-8-10-25(11-9-24)38-19-16-34-17-20-40-21-18-34)28(35-14-12-32(6,7)13-15-35)27(23(2)33-22)29(30(36)37)39-31(3,4)5/h8-11,29H,12-21H2,1-7H3,(H,36,37)/t29-/m0/s1
PDB

UniProtKB/TrEMBL

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 3n/an/an/an/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 US10221156 (2019)

More data for this
Ligand-Target Pair
Envelope glycoprotein gp160


(Human immunodeficiency virus type 1 (isolate BRU/L...)
BDBM359613
PNG
(US10221156, Example 17)
Show SMILES Cc1nc(C)c(-c2ccc(OC3CCCC3c3ccc(F)cc3)cc2)c(N2CCC(C)(C)CC2)c1[C@H](OC(C)(C)C)C(O)=O
Show InChI InChI=1S/C37H47FN2O4/c1-23-31(26-13-17-28(18-14-26)43-30-10-8-9-29(30)25-11-15-27(38)16-12-25)33(40-21-19-37(6,7)20-22-40)32(24(2)39-23)34(35(41)42)44-36(3,4)5/h11-18,29-30,34H,8-10,19-22H2,1-7H3,(H,41,42)/t29?,30?,34-/m0/s1
PDB

UniProtKB/TrEMBL

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 12n/an/an/an/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 US10221156 (2019)

More data for this
Ligand-Target Pair
Envelope glycoprotein gp160


(Human immunodeficiency virus type 1 (isolate BRU/L...)
BDBM359608
PNG
(US10221156, Example 1)
Show SMILES CN1CCN(CCOc2ccc(cc2)-c2c(C)nc(C)c([C@H](OC(C)(C)C)C(O)=O)c2N2CCC(C)(C)CC2)CC1
Show InChI InChI=1S/C33H50N4O4/c1-23-27(25-9-11-26(12-10-25)40-22-21-36-19-17-35(8)18-20-36)29(37-15-13-33(6,7)14-16-37)28(24(2)34-23)30(31(38)39)41-32(3,4)5/h9-12,30H,13-22H2,1-8H3,(H,38,39)/t30-/m0/s1
PDB

UniProtKB/TrEMBL

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 117n/an/an/an/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 US10221156 (2019)

More data for this
Ligand-Target Pair
Envelope glycoprotein gp160


(Human immunodeficiency virus type 1 (isolate BRU/L...)
BDBM359611
PNG
(US10221156, Example 11)
Show SMILES Cc1nc(C)c(-c2ccc(OCC3(CC3)c3ccc(F)cc3)cc2)c(N2CCC(C)(C)CC2)c1[C@H](OC(C)(C)C)C(O)=O
Show InChI InChI=1S/C36H45FN2O4/c1-23-29(25-8-14-28(15-9-25)42-22-36(16-17-36)26-10-12-27(37)13-11-26)31(39-20-18-35(6,7)19-21-39)30(24(2)38-23)32(33(40)41)43-34(3,4)5/h8-15,32H,16-22H2,1-7H3,(H,40,41)/t32-/m0/s1
PDB

UniProtKB/TrEMBL

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 3n/an/an/an/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 US10221156 (2019)

More data for this
Ligand-Target Pair
* indicates data uncertainty>20%