Found 69 hits with Last Name = 'sheng' and Initial = 'xc' Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97773
(US8476225, 34)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)c1ccc(cc1)-c1ccccc1 |r| Show InChI InChI=1S/C37H47N5O7S/c1-5-26-21-37(26,34(45)40-50(47,48)29-19-20-29)39-32(43)30-22-41(27-17-15-25(16-18-27)24-11-7-6-8-12-24)23-42(30)33(44)31(36(2,3)4)38-35(46)49-28-13-9-10-14-28/h5-8,11-12,15-18,26,28-31H,1,9-10,13-14,19-23H2,2-4H3,(H,38,46)(H,39,43)(H,40,45)/t26-,30+,31-,37-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97798
(US8476225, 59)Show SMILES CC(C)(C)[C@H](NC(=O)OC(C)(C)C(F)(F)F)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)c1ccc(cc1)-c1ccccc1 |r| Show InChI InChI=1S/C36H44F3N5O7S/c1-7-24-19-35(24,31(47)42-52(49,50)26-17-18-26)41-29(45)27-20-43(25-15-13-23(14-16-25)22-11-9-8-10-12-22)21-44(27)30(46)28(33(2,3)4)40-32(48)51-34(5,6)36(37,38)39/h7-16,24,26-28H,1,17-21H2,2-6H3,(H,40,48)(H,41,45)(H,42,47)/t24-,27+,28-,35-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97761
(US8476225, 22)Show SMILES COc1ccc(cc1)S(=O)(=O)N1C[C@H](N(C1)C(=O)[C@@H](NC(=O)OC1CCCC1)C(C)(C)C)C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1 |r| Show InChI InChI=1S/C32H45N5O10S2/c1-6-20-17-32(20,29(40)35-48(42,43)23-15-16-23)34-27(38)25-18-36(49(44,45)24-13-11-21(46-5)12-14-24)19-37(25)28(39)26(31(2,3)4)33-30(41)47-22-9-7-8-10-22/h6,11-14,20,22-23,25-26H,1,7-10,15-19H2,2-5H3,(H,33,41)(H,34,38)(H,35,40)/t20-,25+,26-,32-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97758
(US8476225, 19)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)S(=O)(=O)c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C31H42ClN5O9S2/c1-5-19-16-31(19,28(40)35-47(42,43)22-14-15-22)34-26(38)24-17-36(48(44,45)23-12-10-20(32)11-13-23)18-37(24)27(39)25(30(2,3)4)33-29(41)46-21-8-6-7-9-21/h5,10-13,19,21-22,24-25H,1,6-9,14-18H2,2-4H3,(H,33,41)(H,34,38)(H,35,40)/t19-,24+,25-,31-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97753
(US8476225, 14)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)S(=O)(=O)c1ccc(Br)cc1 |r| Show InChI InChI=1S/C31H42BrN5O9S2/c1-5-19-16-31(19,28(40)35-47(42,43)22-14-15-22)34-26(38)24-17-36(48(44,45)23-12-10-20(32)11-13-23)18-37(24)27(39)25(30(2,3)4)33-29(41)46-21-8-6-7-9-21/h5,10-13,19,21-22,24-25H,1,6-9,14-18H2,2-4H3,(H,33,41)(H,34,38)(H,35,40)/t19-,24+,25-,31-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97799
(US8476225, 60)Show SMILES CC(C)(C)OC(=O)N[C@H]1CCCCC\C=C/[C@@H]2C[C@]2(NC(=O)[C@@H]2CN(CN2C1=O)c1ccc(cc1)-c1ccccc1)C(=O)NS(=O)(=O)C1CC1 |r,c:14| Show InChI InChI=1S/C37H47N5O7S/c1-36(2,3)49-35(46)38-30-15-11-6-4-5-10-14-27-22-37(27,34(45)40-50(47,48)29-20-21-29)39-32(43)31-23-41(24-42(31)33(30)44)28-18-16-26(17-19-28)25-12-8-7-9-13-25/h7-10,12-14,16-19,27,29-31H,4-6,11,15,20-24H2,1-3H3,(H,38,46)(H,39,43)(H,40,45)/b14-10-/t27-,30+,31+,37-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97789
(US8476225, 50)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)S(=O)(=O)c1ccc(cc1)N1CCCCC1 |r| Show InChI InChI=1S/C36H52N6O9S2/c1-5-24-21-36(24,33(45)39-52(47,48)27-17-18-27)38-31(43)29-22-41(53(49,50)28-15-13-25(14-16-28)40-19-9-6-10-20-40)23-42(29)32(44)30(35(2,3)4)37-34(46)51-26-11-7-8-12-26/h5,13-16,24,26-27,29-30H,1,6-12,17-23H2,2-4H3,(H,37,46)(H,38,43)(H,39,45)/t24-,29+,30-,36-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 3 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97763
(US8476225, 24)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)S(=O)(=O)c1ccsc1 |r| Show InChI InChI=1S/C29H41N5O9S3/c1-5-18-14-29(18,26(37)32-45(39,40)20-10-11-20)31-24(35)22-15-33(46(41,42)21-12-13-44-16-21)17-34(22)25(36)23(28(2,3)4)30-27(38)43-19-8-6-7-9-19/h5,12-13,16,18-20,22-23H,1,6-11,14-15,17H2,2-4H3,(H,30,38)(H,31,35)(H,32,37)/t18-,22+,23-,29-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 3 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97749
(US8476225, 10)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)S(=O)(=O)c1ccc(F)cc1 |r| Show InChI InChI=1S/C31H42FN5O9S2/c1-5-19-16-31(19,28(40)35-47(42,43)22-14-15-22)34-26(38)24-17-36(48(44,45)23-12-10-20(32)11-13-23)18-37(24)27(39)25(30(2,3)4)33-29(41)46-21-8-6-7-9-21/h5,10-13,19,21-22,24-25H,1,6-9,14-18H2,2-4H3,(H,33,41)(H,34,38)(H,35,40)/t19-,24+,25-,31-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 4 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97760
(US8476225, 21)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)S(=O)(=O)c1ccc(cc1)C(F)(F)F |r| Show InChI InChI=1S/C32H42F3N5O9S2/c1-5-19-16-31(19,28(43)38-50(45,46)22-14-15-22)37-26(41)24-17-39(51(47,48)23-12-10-20(11-13-23)32(33,34)35)18-40(24)27(42)25(30(2,3)4)36-29(44)49-21-8-6-7-9-21/h5,10-13,19,21-22,24-25H,1,6-9,14-18H2,2-4H3,(H,36,44)(H,37,41)(H,38,43)/t19-,24+,25-,31-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 4 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97797
(US8476225, 58)Show SMILES CC(C)(C)OC(=O)N[C@H](C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)c1ccc(cc1)-c1ccccc1)C(C)(C)C |r| Show InChI InChI=1S/C36H47N5O7S/c1-8-25-20-36(25,32(44)39-49(46,47)27-18-19-27)38-30(42)28-21-40(26-16-14-24(15-17-26)23-12-10-9-11-13-23)22-41(28)31(43)29(34(2,3)4)37-33(45)48-35(5,6)7/h8-17,25,27-29H,1,18-22H2,2-7H3,(H,37,45)(H,38,42)(H,39,44)/t25-,28+,29-,36-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97777
(US8476225, 38)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)c1ccc(cc1)C1CCCCC1 |r| Show InChI InChI=1S/C37H53N5O7S/c1-5-26-21-37(26,34(45)40-50(47,48)29-19-20-29)39-32(43)30-22-41(27-17-15-25(16-18-27)24-11-7-6-8-12-24)23-42(30)33(44)31(36(2,3)4)38-35(46)49-28-13-9-10-14-28/h5,15-18,24,26,28-31H,1,6-14,19-23H2,2-4H3,(H,38,46)(H,39,43)(H,40,45)/t26-,30+,31-,37-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97746
(US8476225, 7)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)S(=O)(=O)c1ccccc1 |r| Show InChI InChI=1S/C31H43N5O9S2/c1-5-20-17-31(20,28(39)34-46(41,42)22-15-16-22)33-26(37)24-18-35(47(43,44)23-13-7-6-8-14-23)19-36(24)27(38)25(30(2,3)4)32-29(40)45-21-11-9-10-12-21/h5-8,13-14,20-22,24-25H,1,9-12,15-19H2,2-4H3,(H,32,40)(H,33,37)(H,34,39)/t20-,24+,25-,31-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97759
(US8476225, 20)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)S(=O)(=O)c1ccc(cc1)C#N |r| Show InChI InChI=1S/C32H42N6O9S2/c1-5-21-16-32(21,29(41)36-48(43,44)23-14-15-23)35-27(39)25-18-37(49(45,46)24-12-10-20(17-33)11-13-24)19-38(25)28(40)26(31(2,3)4)34-30(42)47-22-8-6-7-9-22/h5,10-13,21-23,25-26H,1,6-9,14-16,18-19H2,2-4H3,(H,34,42)(H,35,39)(H,36,41)/t21-,25+,26-,32-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97762
(US8476225, 23)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)S(=O)(=O)c1cccs1 |r| Show InChI InChI=1S/C29H41N5O9S3/c1-5-18-15-29(18,26(37)32-45(39,40)20-12-13-20)31-24(35)21-16-33(46(41,42)22-11-8-14-44-22)17-34(21)25(36)23(28(2,3)4)30-27(38)43-19-9-6-7-10-19/h5,8,11,14,18-21,23H,1,6-7,9-10,12-13,15-17H2,2-4H3,(H,30,38)(H,31,35)(H,32,37)/t18-,21+,23-,29-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97770
(US8476225, 31)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)c1ccc(cc1)N1CCCCC1 |r| Show InChI InChI=1S/C36H52N6O7S/c1-5-24-21-36(24,33(45)39-50(47,48)28-17-18-28)38-31(43)29-22-41(26-15-13-25(14-16-26)40-19-9-6-10-20-40)23-42(29)32(44)30(35(2,3)4)37-34(46)49-27-11-7-8-12-27/h5,13-16,24,27-30H,1,6-12,17-23H2,2-4H3,(H,37,46)(H,38,43)(H,39,45)/t24-,29+,30-,36-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 9 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97772
(US8476225, 33)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)c1ccc(cc1)-n1cccn1 |r| Show InChI InChI=1S/C34H45N7O7S/c1-5-22-19-34(22,31(44)38-49(46,47)26-15-16-26)37-29(42)27-20-39(23-11-13-24(14-12-23)41-18-8-17-35-41)21-40(27)30(43)28(33(2,3)4)36-32(45)48-25-9-6-7-10-25/h5,8,11-14,17-18,22,25-28H,1,6-7,9-10,15-16,19-21H2,2-4H3,(H,36,45)(H,37,42)(H,38,44)/t22-,27+,28-,34-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 9 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97771
(US8476225, 32)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)c1ccc(cc1)N1CCOCC1 |r| Show InChI InChI=1S/C35H50N6O8S/c1-5-23-20-35(23,32(44)38-50(46,47)27-14-15-27)37-30(42)28-21-40(25-12-10-24(11-13-25)39-16-18-48-19-17-39)22-41(28)31(43)29(34(2,3)4)36-33(45)49-26-8-6-7-9-26/h5,10-13,23,26-29H,1,6-9,14-22H2,2-4H3,(H,36,45)(H,37,42)(H,38,44)/t23-,28+,29-,35-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97747
(US8476225, 8)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)S(=O)(=O)c1ccccc1F |r| Show InChI InChI=1S/C31H42FN5O9S2/c1-5-19-16-31(19,28(40)35-47(42,43)21-14-15-21)34-26(38)23-17-36(48(44,45)24-13-9-8-12-22(24)32)18-37(23)27(39)25(30(2,3)4)33-29(41)46-20-10-6-7-11-20/h5,8-9,12-13,19-21,23,25H,1,6-7,10-11,14-18H2,2-4H3,(H,33,41)(H,34,38)(H,35,40)/t19-,23+,25-,31-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 11 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97776
(US8476225, 37)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)c1ccc2ccccc2c1 |r| Show InChI InChI=1S/C35H45N5O7S/c1-5-24-19-35(24,32(43)38-48(45,46)27-16-17-27)37-30(41)28-20-39(25-15-14-22-10-6-7-11-23(22)18-25)21-40(28)31(42)29(34(2,3)4)36-33(44)47-26-12-8-9-13-26/h5-7,10-11,14-15,18,24,26-29H,1,8-9,12-13,16-17,19-21H2,2-4H3,(H,36,44)(H,37,41)(H,38,43)/t24-,28+,29-,35-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97774
(US8476225, 35)Show SMILES COc1ccc(cc1)N1C[C@H](N(C1)C(=O)[C@@H](NC(=O)OC1CCCC1)C(C)(C)C)C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1 |r| Show InChI InChI=1S/C32H45N5O8S/c1-6-20-17-32(20,29(40)35-46(42,43)24-15-16-24)34-27(38)25-18-36(21-11-13-22(44-5)14-12-21)19-37(25)28(39)26(31(2,3)4)33-30(41)45-23-9-7-8-10-23/h6,11-14,20,23-26H,1,7-10,15-19H2,2-5H3,(H,33,41)(H,34,38)(H,35,40)/t20-,25+,26-,32-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97744
(US8476225, 5)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(CCc2ccccc2)C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1 |r| Show InChI InChI=1S/C33H47N5O7S/c1-5-23-19-33(23,30(41)36-46(43,44)25-15-16-25)35-28(39)26-20-37(18-17-22-11-7-6-8-12-22)21-38(26)29(40)27(32(2,3)4)34-31(42)45-24-13-9-10-14-24/h5-8,11-12,23-27H,1,9-10,13-21H2,2-4H3,(H,34,42)(H,35,39)(H,36,41)/t23-,26+,27-,33-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97769
(US8476225, 30)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)c1cccc(c1)-c1ccccc1 |r| Show InChI InChI=1S/C37H47N5O7S/c1-5-26-21-37(26,34(45)40-50(47,48)29-18-19-29)39-32(43)30-22-41(27-15-11-14-25(20-27)24-12-7-6-8-13-24)23-42(30)33(44)31(36(2,3)4)38-35(46)49-28-16-9-10-17-28/h5-8,11-15,20,26,28-31H,1,9-10,16-19,21-23H2,2-4H3,(H,38,46)(H,39,43)(H,40,45)/t26-,30+,31-,37-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97748
(US8476225, 9)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)S(=O)(=O)c1cccc(F)c1 |r| Show InChI InChI=1S/C31H42FN5O9S2/c1-5-19-16-31(19,28(40)35-47(42,43)22-13-14-22)34-26(38)24-17-36(48(44,45)23-12-8-9-20(32)15-23)18-37(24)27(39)25(30(2,3)4)33-29(41)46-21-10-6-7-11-21/h5,8-9,12,15,19,21-22,24-25H,1,6-7,10-11,13-14,16-18H2,2-4H3,(H,33,41)(H,34,38)(H,35,40)/t19-,24+,25-,31-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 14 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97764
(US8476225, 25)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)S(=O)(=O)Cc1ccccc1 |r| Show InChI InChI=1S/C32H45N5O9S2/c1-5-22-17-32(22,29(40)35-48(44,45)24-15-16-24)34-27(38)25-18-36(47(42,43)19-21-11-7-6-8-12-21)20-37(25)28(39)26(31(2,3)4)33-30(41)46-23-13-9-10-14-23/h5-8,11-12,22-26H,1,9-10,13-20H2,2-4H3,(H,33,41)(H,34,38)(H,35,40)/t22-,25+,26-,32-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 14 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97756
(US8476225, 17)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)S(=O)(=O)c1ccccc1Cl |r| Show InChI InChI=1S/C31H42ClN5O9S2/c1-5-19-16-31(19,28(40)35-47(42,43)21-14-15-21)34-26(38)23-17-36(48(44,45)24-13-9-8-12-22(24)32)18-37(23)27(39)25(30(2,3)4)33-29(41)46-20-10-6-7-11-20/h5,8-9,12-13,19-21,23,25H,1,6-7,10-11,14-18H2,2-4H3,(H,33,41)(H,34,38)(H,35,40)/t19-,23+,25-,31-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 16 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97775
(US8476225, 36)Show SMILES CC(C)c1ccc(cc1)N1C[C@H](N(C1)C(=O)[C@@H](NC(=O)OC1CCCC1)C(C)(C)C)C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1 |r| Show InChI InChI=1S/C34H49N5O7S/c1-7-23-18-34(23,31(42)37-47(44,45)26-16-17-26)36-29(40)27-19-38(24-14-12-22(13-15-24)21(2)3)20-39(27)30(41)28(33(4,5)6)35-32(43)46-25-10-8-9-11-25/h7,12-15,21,23,25-28H,1,8-11,16-20H2,2-6H3,(H,35,43)(H,36,40)(H,37,42)/t23-,27+,28-,34-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 16 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97767
(US8476225, 28)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)c1ccccc1 |r| Show InChI InChI=1S/C31H43N5O7S/c1-5-20-17-31(20,28(39)34-44(41,42)23-15-16-23)33-26(37)24-18-35(21-11-7-6-8-12-21)19-36(24)27(38)25(30(2,3)4)32-29(40)43-22-13-9-10-14-22/h5-8,11-12,20,22-25H,1,9-10,13-19H2,2-4H3,(H,32,40)(H,33,37)(H,34,39)/t20-,24+,25-,31-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 19 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97800
(US8476225, 61)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)S(=O)(=O)c1ccccc1Br |r| Show InChI InChI=1S/C31H42BrN5O9S2/c1-5-19-16-31(19,28(40)35-47(42,43)21-14-15-21)34-26(38)23-17-36(48(44,45)24-13-9-8-12-22(24)32)18-37(23)27(39)25(30(2,3)4)33-29(41)46-20-10-6-7-11-20/h5,8-9,12-13,19-21,23,25H,1,6-7,10-11,14-18H2,2-4H3,(H,33,41)(H,34,38)(H,35,40)/t19-,23+,25-,31-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97778
(US8476225, 39)Show SMILES COc1ccccc1-c1ccc(cc1)N1C[C@H](N(C1)C(=O)[C@@H](NC(=O)OC1CCCC1)C(C)(C)C)C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1 |r| Show InChI InChI=1S/C38H49N5O8S/c1-6-25-21-38(25,35(46)41-52(48,49)28-19-20-28)40-33(44)30-22-42(26-17-15-24(16-18-26)29-13-9-10-14-31(29)50-5)23-43(30)34(45)32(37(2,3)4)39-36(47)51-27-11-7-8-12-27/h6,9-10,13-18,25,27-28,30,32H,1,7-8,11-12,19-23H2,2-5H3,(H,39,47)(H,40,44)(H,41,46)/t25-,30+,32-,38-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 21 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97743
(US8476225, 4)Show SMILES CC(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(CC(=O)c2ccccc2)C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1 |r| Show InChI InChI=1S/C32H43N5O8S/c1-4-22-16-32(22,30(41)35-46(43,44)24-14-15-24)34-28(39)25-17-36(18-26(38)21-10-6-5-7-11-21)19-37(25)29(40)27(20(2)3)33-31(42)45-23-12-8-9-13-23/h4-7,10-11,20,22-25,27H,1,8-9,12-19H2,2-3H3,(H,33,42)(H,34,39)(H,35,41)/t22-,25+,27+,32-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 21 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97750
(US8476225, 11)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)S(=O)(=O)c1ccc2ccccc2c1 |r| Show InChI InChI=1S/C35H45N5O9S2/c1-5-24-19-35(24,32(43)38-50(45,46)26-16-17-26)37-30(41)28-20-39(51(47,48)27-15-14-22-10-6-7-11-23(22)18-27)21-40(28)31(42)29(34(2,3)4)36-33(44)49-25-12-8-9-13-25/h5-7,10-11,14-15,18,24-26,28-29H,1,8-9,12-13,16-17,19-21H2,2-4H3,(H,36,44)(H,37,41)(H,38,43)/t24-,28+,29-,35-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 22 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97757
(US8476225, 18)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)S(=O)(=O)c1cccc(Cl)c1 |r| Show InChI InChI=1S/C31H42ClN5O9S2/c1-5-19-16-31(19,28(40)35-47(42,43)22-13-14-22)34-26(38)24-17-36(48(44,45)23-12-8-9-20(32)15-23)18-37(24)27(39)25(30(2,3)4)33-29(41)46-21-10-6-7-11-21/h5,8-9,12,15,19,21-22,24-25H,1,6-7,10-11,13-14,16-18H2,2-4H3,(H,33,41)(H,34,38)(H,35,40)/t19-,24+,25-,31-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 28 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97787
(US8476225, 48)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)c1ccc(cc1)-c1ccc(cc1)C#N |r| Show InChI InChI=1S/C38H46N6O7S/c1-5-27-20-38(27,35(47)42-52(49,50)30-18-19-30)41-33(45)31-22-43(28-16-14-26(15-17-28)25-12-10-24(21-39)11-13-25)23-44(31)34(46)32(37(2,3)4)40-36(48)51-29-8-6-7-9-29/h5,10-17,27,29-32H,1,6-9,18-20,22-23H2,2-4H3,(H,40,48)(H,41,45)(H,42,47)/t27-,31+,32-,38-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 28 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97754
(US8476225, 15)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)S(=O)(=O)c1cccc(Br)c1 |r| Show InChI InChI=1S/C31H42BrN5O9S2/c1-5-19-16-31(19,28(40)35-47(42,43)22-13-14-22)34-26(38)24-17-36(48(44,45)23-12-8-9-20(32)15-23)18-37(24)27(39)25(30(2,3)4)33-29(41)46-21-10-6-7-11-21/h5,8-9,12,15,19,21-22,24-25H,1,6-7,10-11,13-14,16-18H2,2-4H3,(H,33,41)(H,34,38)(H,35,40)/t19-,24+,25-,31-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 32 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97779
(US8476225, 40)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)c1ccc(cc1)-c1ccccc1F |r| Show InChI InChI=1S/C37H46FN5O7S/c1-5-24-20-37(24,34(46)41-51(48,49)27-18-19-27)40-32(44)30-21-42(25-16-14-23(15-17-25)28-12-8-9-13-29(28)38)22-43(30)33(45)31(36(2,3)4)39-35(47)50-26-10-6-7-11-26/h5,8-9,12-17,24,26-27,30-31H,1,6-7,10-11,18-22H2,2-4H3,(H,39,47)(H,40,44)(H,41,46)/t24-,30+,31-,37-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 34 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97780
(US8476225, 41)Show SMILES Cc1ccccc1-c1ccc(cc1)N1C[C@H](N(C1)C(=O)[C@@H](NC(=O)OC1CCCC1)C(C)(C)C)C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1 |r| Show InChI InChI=1S/C38H49N5O7S/c1-6-26-21-38(26,35(46)41-51(48,49)29-19-20-29)40-33(44)31-22-42(27-17-15-25(16-18-27)30-14-10-7-11-24(30)2)23-43(31)34(45)32(37(3,4)5)39-36(47)50-28-12-8-9-13-28/h6-7,10-11,14-18,26,28-29,31-32H,1,8-9,12-13,19-23H2,2-5H3,(H,39,47)(H,40,44)(H,41,46)/t26-,31+,32-,38-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 39 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97783
(US8476225, 44)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)c1ccc(cc1)-c1ccsc1 |r| Show InChI InChI=1S/C35H45N5O7S2/c1-5-24-18-35(24,32(43)38-49(45,46)27-14-15-27)37-30(41)28-19-39(25-12-10-22(11-13-25)23-16-17-48-20-23)21-40(28)31(42)29(34(2,3)4)36-33(44)47-26-8-6-7-9-26/h5,10-13,16-17,20,24,26-29H,1,6-9,14-15,18-19,21H2,2-4H3,(H,36,44)(H,37,41)(H,38,43)/t24-,28+,29-,35-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 40 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97768
(US8476225, 29)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)c1ccc(Br)cc1 |r| Show InChI InChI=1S/C31H42BrN5O7S/c1-5-19-16-31(19,28(40)35-45(42,43)23-14-15-23)34-26(38)24-17-36(21-12-10-20(32)11-13-21)18-37(24)27(39)25(30(2,3)4)33-29(41)44-22-8-6-7-9-22/h5,10-13,19,22-25H,1,6-9,14-18H2,2-4H3,(H,33,41)(H,34,38)(H,35,40)/t19-,24+,25-,31-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 41 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97782
(US8476225, 43)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)c1ccc(cc1)-c1ccc(F)cc1 |r| Show InChI InChI=1S/C37H46FN5O7S/c1-5-25-20-37(25,34(46)41-51(48,49)29-18-19-29)40-32(44)30-21-42(27-16-12-24(13-17-27)23-10-14-26(38)15-11-23)22-43(30)33(45)31(36(2,3)4)39-35(47)50-28-8-6-7-9-28/h5,10-17,25,28-31H,1,6-9,18-22H2,2-4H3,(H,39,47)(H,40,44)(H,41,46)/t25-,30+,31-,37-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 45 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97742
(US8476225, 3)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)C(=O)OCc1ccccc1 |r| Show InChI InChI=1S/C33H45N5O9S/c1-5-22-17-33(22,29(41)36-48(44,45)24-15-16-24)35-27(39)25-18-37(31(43)46-19-21-11-7-6-8-12-21)20-38(25)28(40)26(32(2,3)4)34-30(42)47-23-13-9-10-14-23/h5-8,11-12,22-26H,1,9-10,13-20H2,2-4H3,(H,34,42)(H,35,39)(H,36,41)/t22-,25+,26-,33-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 57 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97766
(US8476225, 27)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)S(=O)(=O)Nc1ccccc1 |r| Show InChI InChI=1S/C31H44N6O9S2/c1-5-20-17-31(20,28(40)35-47(42,43)23-15-16-23)33-26(38)24-18-36(48(44,45)34-21-11-7-6-8-12-21)19-37(24)27(39)25(30(2,3)4)32-29(41)46-22-13-9-10-14-22/h5-8,11-12,20,22-25,34H,1,9-10,13-19H2,2-4H3,(H,32,41)(H,33,38)(H,35,40)/t20-,24+,25-,31-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 61 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97785
(US8476225, 46)Show SMILES COc1ccc(cc1)-c1ccc(cc1)N1C[C@H](N(C1)C(=O)[C@@H](NC(=O)OC1CCCC1)C(C)(C)C)C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1 |r| Show InChI InChI=1S/C38H49N5O8S/c1-6-26-21-38(26,35(46)41-52(48,49)30-19-20-30)40-33(44)31-22-42(27-15-11-24(12-16-27)25-13-17-28(50-5)18-14-25)23-43(31)34(45)32(37(2,3)4)39-36(47)51-29-9-7-8-10-29/h6,11-18,26,29-32H,1,7-10,19-23H2,2-5H3,(H,39,47)(H,40,44)(H,41,46)/t26-,31+,32-,38-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 66 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97755
(US8476225, 16)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)S(=O)(=O)c1cnc(Cl)c(Br)c1 |r| Show InChI InChI=1S/C30H40BrClN6O9S2/c1-5-17-13-30(17,27(41)36-48(43,44)19-10-11-19)35-25(39)22-15-37(49(45,46)20-12-21(31)24(32)33-14-20)16-38(22)26(40)23(29(2,3)4)34-28(42)47-18-8-6-7-9-18/h5,12,14,17-19,22-23H,1,6-11,13,15-16H2,2-4H3,(H,34,42)(H,35,39)(H,36,41)/t17-,22+,23-,30-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 68 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97781
(US8476225, 42)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)c1ccc(cc1)-c1cccc(F)c1 |r| Show InChI InChI=1S/C37H46FN5O7S/c1-5-25-20-37(25,34(46)41-51(48,49)29-17-18-29)40-32(44)30-21-42(27-15-13-23(14-16-27)24-9-8-10-26(38)19-24)22-43(30)33(45)31(36(2,3)4)39-35(47)50-28-11-6-7-12-28/h5,8-10,13-16,19,25,28-31H,1,6-7,11-12,17-18,20-22H2,2-4H3,(H,39,47)(H,40,44)(H,41,46)/t25-,30+,31-,37-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 82 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97786
(US8476225, 47)Show SMILES COc1cccc(c1)-c1ccc(cc1)N1C[C@H](N(C1)C(=O)[C@@H](NC(=O)OC1CCCC1)C(C)(C)C)C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1 |r| Show InChI InChI=1S/C38H49N5O8S/c1-6-26-21-38(26,35(46)41-52(48,49)30-18-19-30)40-33(44)31-22-42(27-16-14-24(15-17-27)25-10-9-13-29(20-25)50-5)23-43(31)34(45)32(37(2,3)4)39-36(47)51-28-11-7-8-12-28/h6,9-10,13-17,20,26,28,30-32H,1,7-8,11-12,18-19,21-23H2,2-5H3,(H,39,47)(H,40,44)(H,41,46)/t26-,31+,32-,38-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 110 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97752
(US8476225, 13)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)S(=O)(=O)c1cccc2cccnc12 |r| Show InChI InChI=1S/C34H44N6O9S2/c1-5-22-18-34(22,31(43)38-50(45,46)24-15-16-24)37-29(41)25-19-39(51(47,48)26-14-8-10-21-11-9-17-35-27(21)26)20-40(25)30(42)28(33(2,3)4)36-32(44)49-23-12-6-7-13-23/h5,8-11,14,17,22-25,28H,1,6-7,12-13,15-16,18-20H2,2-4H3,(H,36,44)(H,37,41)(H,38,43)/t22-,25+,28-,34-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 160 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97751
(US8476225, 12)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)S(=O)(=O)c1cccc2ccccc12 |r| Show InChI InChI=1S/C35H45N5O9S2/c1-5-23-19-35(23,32(43)38-50(45,46)25-17-18-25)37-30(41)27-20-39(51(47,48)28-16-10-12-22-11-6-9-15-26(22)28)21-40(27)31(42)29(34(2,3)4)36-33(44)49-24-13-7-8-14-24/h5-6,9-12,15-16,23-25,27,29H,1,7-8,13-14,17-21H2,2-4H3,(H,36,44)(H,37,41)(H,38,43)/t23-,27+,29-,35-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 170 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97740
(US8476225, 1)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(Cc2ccccc2)C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1 |r| Show InChI InChI=1S/C32H45N5O7S/c1-5-22-17-32(22,29(40)35-45(42,43)24-15-16-24)34-27(38)25-19-36(18-21-11-7-6-8-12-21)20-37(25)28(39)26(31(2,3)4)33-30(41)44-23-13-9-10-14-23/h5-8,11-12,22-26H,1,9-10,13-20H2,2-4H3,(H,33,41)(H,34,38)(H,35,40)/t22-,25+,26-,32-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 195 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
Genome polyprotein [1027-1657]
(Hepatitis C virus genotype 1a (isolate 1) (HCV)) | BDBM97745
(US8476225, 6)Show SMILES CC(C)(C)[C@H](NC(=O)OC1CCCC1)C(=O)N1CN(C[C@H]1C(=O)N[C@@]1(C[C@H]1C=C)C(=O)NS(=O)(=O)C1CC1)C(=O)c1ccccc1 |r| Show InChI InChI=1S/C32H43N5O8S/c1-5-21-17-32(21,29(41)35-46(43,44)23-15-16-23)34-26(38)24-18-36(27(39)20-11-7-6-8-12-20)19-37(24)28(40)25(31(2,3)4)33-30(42)45-22-13-9-10-14-22/h5-8,11-12,21-25H,1,9-10,13-19H2,2-4H3,(H,33,42)(H,34,38)(H,35,41)/t21-,24+,25-,32-/m1/s1 | PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| n/a | n/a | 403 | n/a | n/a | n/a | n/a | 7.5 | 37 |
Gilead Sciences, Inc.
US Patent
| Assay Description
Inhibition assay using HCV protease. |
US Patent US8476225 (2013)
BindingDB Entry DOI: 10.7270/Q2M32TD9 |
More data for this
Ligand-Target Pair | |
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