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Compile Data Set for Download or QSAR

Found 105 hits Enz. Inhib. hit(s) with Target = 'Ribonucleoside-diphosphate reductase large chain' AND taxid = 10299   
Target
(Institution)
LigandTarget
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
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50050831
PNG
((S)-2-[(S)-3-Carboxy-2-((S)-2-{(S)-2-[3-(1-ethyl-p...)
Show SMILES CCC(CC)NC(=O)N[C@H](C(=O)N[C@@H](CC(=O)N1CCCC1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(O)=O)C(C)(C)C
Show InChI InChI=1S/C30H52N6O9/c1-8-18(9-2)31-29(45)35-24(30(5,6)7)27(42)33-19(15-22(37)36-12-10-11-13-36)25(40)32-20(16-23(38)39)26(41)34-21(28(43)44)14-17(3)4/h17-21,24H,8-16H2,1-7H3,(H,32,40)(H,33,42)(H,34,41)(H,38,39)(H,43,44)(H2,31,35,45)/t19-,20-,21-,24+/m0/s1
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n/an/a 3n/an/an/an/an/an/a



Bio-Méga/Boehringer Ingelheim Research Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Herpes simplex virus (HSV) ribonucleotide reductase (RR)


Citation and Details
More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50050824
PNG
((S)-2-[(S)-3-Carboxy-2-((S)-2-{(S)-2-[(1-ethyl-pro...)
Show SMILES CCC(CC)NC(=O)C[C@H](C(=O)N[C@@H](CC(=O)N1CCCC1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(O)=O)C(C)(C)C
Show InChI InChI=1S/C31H53N5O9/c1-8-19(9-2)32-24(37)15-20(31(5,6)7)27(41)33-21(16-25(38)36-12-10-11-13-36)28(42)34-22(17-26(39)40)29(43)35-23(30(44)45)14-18(3)4/h18-23H,8-17H2,1-7H3,(H,32,37)(H,33,41)(H,34,42)(H,35,43)(H,39,40)(H,44,45)/t20-,21+,22+,23+/m1/s1
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n/an/a 5n/an/an/an/an/an/a



Bio-Méga/Boehringer Ingelheim Research Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Herpes simplex virus (HSV) ribonucleotide reductase (RR)


Citation and Details
More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50050828
PNG
((S)-2-[(S)-3-Carboxy-2-((S)-2-{(S)-3-methyl-2-[3-(...)
Show SMILES CCCC(CCC)NC(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(=O)N1CCCC1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(O)=O
Show InChI InChI=1S/C31H54N6O9/c1-7-11-20(12-8-2)32-31(46)36-26(19(5)6)29(43)34-21(16-24(38)37-13-9-10-14-37)27(41)33-22(17-25(39)40)28(42)35-23(30(44)45)15-18(3)4/h18-23,26H,7-17H2,1-6H3,(H,33,41)(H,34,43)(H,35,42)(H,39,40)(H,44,45)(H2,32,36,46)/t21-,22-,23-,26-/m0/s1
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n/an/a 7n/an/an/an/an/an/a



Bio-Méga/Boehringer Ingelheim Research Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Herpes simplex virus (HSV) ribonucleotide reductase (RR)


Citation and Details
More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50050822
PNG
((S)-2-{(S)-3-Carboxy-2-[(1-{(S)-2-[3-(1-ethyl-prop...)
Show SMILES CCC(CC)NC(=O)N[C@H](C(=O)N1CCCC(C1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(O)=O)C(=O)NC)C(C)(C)C
Show InChI InChI=1S/C30H52N6O9/c1-9-17(10-2)32-29(45)35-23(30(5,6)7)27(42)36-13-11-12-18(24(39)31-8)22(36)26(41)33-19(15-21(37)38)25(40)34-20(28(43)44)14-16(3)4/h16-20,22-23H,9-15H2,1-8H3,(H,31,39)(H,33,41)(H,34,40)(H,37,38)(H,43,44)(H2,32,35,45)/t18?,19-,20-,22?,23+/m0/s1
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n/an/a 10n/an/an/an/an/an/a



Bio-Méga/Boehringer Ingelheim Research Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Herpes simplex virus (HSV) ribonucleotide reductase (RR)


Citation and Details
More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50050826
PNG
((S)-2-[(S)-3-Carboxy-2-((S)-2-{(S)-2-[3-(1-ethyl-p...)
Show SMILES CCC(CC)NC(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(=O)N1CCCC1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(O)=O
Show InChI InChI=1S/C29H50N6O9/c1-7-18(8-2)30-29(44)34-24(17(5)6)27(41)32-19(14-22(36)35-11-9-10-12-35)25(39)31-20(15-23(37)38)26(40)33-21(28(42)43)13-16(3)4/h16-21,24H,7-15H2,1-6H3,(H,31,39)(H,32,41)(H,33,40)(H,37,38)(H,42,43)(H2,30,34,44)/t19-,20-,21-,24-/m0/s1
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n/an/a 15n/an/an/an/an/an/a



Bio-Méga/Boehringer Ingelheim Research Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Herpes simplex virus (HSV) ribonucleotide reductase (RR)


Citation and Details
More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50033462
PNG
((S)-2-[(S)-3-Carboxy-2-((S)-2-{(S)-3-methyl-2-[(S)...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(=O)N1CCCC1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CCc1ccccc1)C(C)C)C(C)C)C(O)=O
Show InChI InChI=1S/C37H56N6O10/c1-21(2)18-27(37(52)53)40-34(49)26(20-30(46)47)38-33(48)25(19-29(45)43-16-10-11-17-43)39-35(50)32(23(5)6)42-36(51)31(22(3)4)41-28(44)15-14-24-12-8-7-9-13-24/h7-9,12-13,21-23,25-27,31-32H,10-11,14-20H2,1-6H3,(H,38,48)(H,39,50)(H,40,49)(H,41,44)(H,42,51)(H,46,47)(H,52,53)/t25-,26-,27-,31-,32-/m0/s1
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n/an/a 24n/an/an/an/an/an/a



Bio-Méga/Boehringer Ingelheim Research Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Herpes simplex virus (HSV) ribonucleotide reductase (RR)


Citation and Details
More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50050833
PNG
((S)-2-[(S)-3-Carboxy-2-(2-{(S)-2-[3-(1-ethyl-propy...)
Show SMILES CCC(CC)NC(=O)N[C@H](C(=O)N[C@@H](CC(=O)NC)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(O)=O)C(C)(C)C
Show InChI InChI=1S/C27H48N6O9/c1-9-15(10-2)29-26(42)33-21(27(5,6)7)24(39)31-16(12-19(34)28-8)22(37)30-17(13-20(35)36)23(38)32-18(25(40)41)11-14(3)4/h14-18,21H,9-13H2,1-8H3,(H,28,34)(H,30,37)(H,31,39)(H,32,38)(H,35,36)(H,40,41)(H2,29,33,42)/t16-,17-,18-,21+/m0/s1
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n/an/a 35n/an/an/an/an/an/a



Bio-Méga/Boehringer Ingelheim Research Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Herpes simplex virus (HSV) ribonucleotide reductase (RR)


Citation and Details
More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50050825
PNG
((S)-2-((S)-3-Carboxy-2-{[1-{(S)-2-[3-(1-ethyl-prop...)
Show SMILES CCC(CC)NC(=O)N[C@H](C(=O)N1CCC([C@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(O)=O)C(=O)N1CCCC1)C(C)(C)C
Show InChI InChI=1S/C32H54N6O9/c1-8-19(9-2)33-31(47)36-25(32(5,6)7)29(44)38-15-12-20(28(43)37-13-10-11-14-37)24(38)27(42)34-21(17-23(39)40)26(41)35-22(30(45)46)16-18(3)4/h18-22,24-25H,8-17H2,1-7H3,(H,34,42)(H,35,41)(H,39,40)(H,45,46)(H2,33,36,47)/t20?,21-,22-,24-,25+/m0/s1
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n/an/a 108n/an/an/an/an/an/a



Bio-Méga/Boehringer Ingelheim Research Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Herpes simplex virus (HSV) ribonucleotide reductase (RR)


Citation and Details
More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50050834
PNG
((S)-2-((S)-3-Carboxy-2-{(S)-2-[(S)-2-(3-ethyl-pent...)
Show SMILES CCC(CC)CC(=O)N[C@H](C(=O)N[C@@H](CC(=O)N1CCCC1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(O)=O)C(C)(C)C
Show InChI InChI=1S/C31H53N5O9/c1-8-19(9-2)15-23(37)35-26(31(5,6)7)29(43)33-20(16-24(38)36-12-10-11-13-36)27(41)32-21(17-25(39)40)28(42)34-22(30(44)45)14-18(3)4/h18-22,26H,8-17H2,1-7H3,(H,32,41)(H,33,43)(H,34,42)(H,35,37)(H,39,40)(H,44,45)/t20-,21-,22-,26+/m0/s1
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n/an/a 140n/an/an/an/an/an/a



Bio-Méga/Boehringer Ingelheim Research Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Herpes simplex virus (HSV) ribonucleotide reductase (RR)


Citation and Details
More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50050835
PNG
((S)-2-[(S)-3-Carboxy-2-((S)-2-{3-[3-(1-ethyl-propy...)
Show SMILES CCC(CC)NC(=O)NC1CCCN([C@@H](CC(=O)N2CCCC2)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(O)=O)C1=O
Show InChI InChI=1S/C29H48N6O9/c1-5-18(6-2)30-29(44)33-19-10-9-13-35(27(19)41)22(16-23(36)34-11-7-8-12-34)26(40)31-20(15-24(37)38)25(39)32-21(28(42)43)14-17(3)4/h17-22H,5-16H2,1-4H3,(H,31,40)(H,32,39)(H,37,38)(H,42,43)(H2,30,33,44)/t19?,20-,21-,22-/m0/s1
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n/an/a 240n/an/an/an/an/an/a



Bio-Méga/Boehringer Ingelheim Research Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Herpes simplex virus (HSV) ribonucleotide reductase (RR)


Citation and Details
More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50050829
PNG
((S)-2-((S)-3-Carboxy-2-{(S)-2-[(S)-2-(3-isopropyl-...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(=O)N1CCCC1)NC(=O)[C@@H](NC(=O)NC(C)C)C(C)C)C(O)=O
Show InChI InChI=1S/C27H46N6O9/c1-14(2)11-19(26(40)41)31-24(38)18(13-21(35)36)29-23(37)17(12-20(34)33-9-7-8-10-33)30-25(39)22(15(3)4)32-27(42)28-16(5)6/h14-19,22H,7-13H2,1-6H3,(H,29,37)(H,30,39)(H,31,38)(H,35,36)(H,40,41)(H2,28,32,42)/t17-,18-,19-,22-/m0/s1
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n/an/a 435n/an/an/an/an/an/a



Bio-Méga/Boehringer Ingelheim Research Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Herpes simplex virus (HSV) ribonucleotide reductase (RR)


Citation and Details
More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50050830
PNG
((S)-2-((S)-3-Carboxy-2-{(S)-2-[(S)-2-(1-ethyl-prop...)
Show SMILES CCC(CC)OC(=O)N[C@H](C(=O)N[C@@H](CC(=O)N1CCCC1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(O)=O)C(C)(C)C
Show InChI InChI=1S/C30H51N5O10/c1-8-18(9-2)45-29(44)34-24(30(5,6)7)27(41)32-19(15-22(36)35-12-10-11-13-35)25(39)31-20(16-23(37)38)26(40)33-21(28(42)43)14-17(3)4/h17-21,24H,8-16H2,1-7H3,(H,31,39)(H,32,41)(H,33,40)(H,34,44)(H,37,38)(H,42,43)/t19-,20-,21-,24+/m0/s1
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n/an/a 635n/an/an/an/an/an/a



Bio-Méga/Boehringer Ingelheim Research Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Herpes simplex virus (HSV) ribonucleotide reductase (RR)


Citation and Details
More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50050819
PNG
((S)-2-[(S)-3-Carboxy-2-((S)-2-{2-[3-(1-ethyl-propy...)
Show SMILES CCC(CC)NC(=O)NCC(=O)N[C@@H](CC(=O)N1CCCC1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(O)=O
Show InChI InChI=1S/C26H44N6O9/c1-5-16(6-2)28-26(41)27-14-20(33)29-17(12-21(34)32-9-7-8-10-32)23(37)30-18(13-22(35)36)24(38)31-19(25(39)40)11-15(3)4/h15-19H,5-14H2,1-4H3,(H,29,33)(H,30,37)(H,31,38)(H,35,36)(H,39,40)(H2,27,28,41)/t17-,18-,19-/m0/s1
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n/an/a 670n/an/an/an/an/an/a



Bio-Méga/Boehringer Ingelheim Research Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Herpes simplex virus (HSV) ribonucleotide reductase (RR)


Citation and Details
More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50050837
PNG
((S)-2-[(S)-3-Carboxy-2-((S)-2-{3-[3-(1-ethyl-propy...)
Show SMILES CCC(CC)NC(=O)NC1CCN([C@@H](CC(=O)N2CCCC2)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(O)=O)C1=O
Show InChI InChI=1S/C28H46N6O9/c1-5-17(6-2)29-28(43)32-18-9-12-34(26(18)40)21(15-22(35)33-10-7-8-11-33)25(39)30-19(14-23(36)37)24(38)31-20(27(41)42)13-16(3)4/h16-21H,5-15H2,1-4H3,(H,30,39)(H,31,38)(H,36,37)(H,41,42)(H2,29,32,43)/t18?,19-,20-,21-/m0/s1
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n/an/a 800n/an/an/an/an/an/a



Bio-Méga/Boehringer Ingelheim Research Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Herpes simplex virus (HSV) ribonucleotide reductase (RR)


Citation and Details
More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50033460
PNG
((S)-2-((S)-3-Carboxy-2-{(S)-2-[(S)-2-(2-ethyl-buty...)
Show SMILES CCC(CC)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(=O)N1CCCC1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(O)=O
Show InChI InChI=1S/C29H49N5O9/c1-7-18(8-2)25(38)33-24(17(5)6)28(41)31-19(14-22(35)34-11-9-10-12-34)26(39)30-20(15-23(36)37)27(40)32-21(29(42)43)13-16(3)4/h16-21,24H,7-15H2,1-6H3,(H,30,39)(H,31,41)(H,32,40)(H,33,38)(H,36,37)(H,42,43)/t19-,20-,21-,24-/m0/s1
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n/an/a 860n/an/an/an/an/an/a



Bio-Méga/Boehringer Ingelheim Research Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Herpes simplex virus (HSV) ribonucleotide reductase (RR)


Citation and Details
More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50033459
PNG
((S)-2-((S)-2-{(S)-2-[(S)-2-((S)-2-Acetylamino-3-me...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(=O)N1CCCC1)NC(=O)[C@@H](NC(=O)[C@@H](NC(C)=O)C(C)C)C(C)C)C(O)=O
Show InChI InChI=1S/C30H50N6O10/c1-15(2)12-21(30(45)46)34-27(42)20(14-23(39)40)32-26(41)19(13-22(38)36-10-8-9-11-36)33-28(43)25(17(5)6)35-29(44)24(16(3)4)31-18(7)37/h15-17,19-21,24-25H,8-14H2,1-7H3,(H,31,37)(H,32,41)(H,33,43)(H,34,42)(H,35,44)(H,39,40)(H,45,46)/t19-,20-,21-,24-,25-/m0/s1
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n/an/a 880n/an/an/an/an/an/a



Bio-Méga/Boehringer Ingelheim Research Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Herpes simplex virus (HSV) ribonucleotide reductase (RR)


Citation and Details
More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50050821
PNG
((S)-2-((S)-3-Carboxy-2-{[1-{(S)-2-[3-(1-ethyl-prop...)
Show SMILES CCC(CC)NC(=O)N[C@H](C(=O)N1CCCC(C1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(O)=O)C(=O)N1CCCC1)C(C)(C)C
Show InChI InChI=1S/C33H56N6O9/c1-8-20(9-2)34-32(48)37-26(33(5,6)7)30(45)39-16-12-13-21(29(44)38-14-10-11-15-38)25(39)28(43)35-22(18-24(40)41)27(42)36-23(31(46)47)17-19(3)4/h19-23,25-26H,8-18H2,1-7H3,(H,35,43)(H,36,42)(H,40,41)(H,46,47)(H2,34,37,48)/t21?,22-,23-,25?,26+/m0/s1
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n/an/a 3.00E+3n/an/an/an/an/an/a



Bio-Méga/Boehringer Ingelheim Research Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Herpes simplex virus (HSV) ribonucleotide reductase (RR)


Citation and Details
More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50050821
PNG
((S)-2-((S)-3-Carboxy-2-{[1-{(S)-2-[3-(1-ethyl-prop...)
Show SMILES CCC(CC)NC(=O)N[C@H](C(=O)N1CCCC(C1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(O)=O)C(=O)N1CCCC1)C(C)(C)C
Show InChI InChI=1S/C33H56N6O9/c1-8-20(9-2)34-32(48)37-26(33(5,6)7)30(45)39-16-12-13-21(29(44)38-14-10-11-15-38)25(39)28(43)35-22(18-24(40)41)27(42)36-23(31(46)47)17-19(3)4/h19-23,25-26H,8-18H2,1-7H3,(H,35,43)(H,36,42)(H,40,41)(H,46,47)(H2,34,37,48)/t21?,22-,23-,25?,26+/m0/s1
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n/an/a 3.00E+3n/an/an/an/an/an/a



Bio-Méga/Boehringer Ingelheim Research Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Herpes simplex virus (HSV) ribonucleotide reductase (RR)


Citation and Details
More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50013347
PNG
(CHEMBL387456 | H2N-C8-Tyr-Ala-Gly-Ala-Val-Val-Asn-...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NCCCCCCCCN)C(C)C)C(C)C)C(O)=O
Show InChI InChI=1S/C49H81N11O14/c1-26(2)21-36(49(73)74)58-46(70)35(24-39(64)65)56-45(69)34(23-37(51)62)57-47(71)40(27(3)4)60-48(72)41(28(5)6)59-43(67)30(8)54-38(63)25-53-42(66)29(7)55-44(68)33(22-31-15-17-32(61)18-16-31)52-20-14-12-10-9-11-13-19-50/h15-18,26-30,33-36,40-41,52,61H,9-14,19-25,50H2,1-8H3,(H2,51,62)(H,53,66)(H,54,63)(H,55,68)(H,56,69)(H,57,71)(H,58,70)(H,59,67)(H,60,72)(H,64,65)(H,73,74)/t29-,30-,33-,34-,35-,36-,40-,41-/m0/s1
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n/an/a 1.20E+4n/an/an/an/an/an/a



Notre-Dame Hospital Research

Curated by ChEMBL


Assay Description
Inhibitory activity was determined against HSV-1 Ribonucleoside diphosphate reductase


J Med Chem 33: 723-30 (1990)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50013377
PNG
(CHEMBL2371369 | desamino-Tyr-Ala-Gly-Thr-Ile-Asn-A...)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](C)NC(=O)CCc1ccc(O)cc1)C(C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(O)=O
Show InChI InChI=1S/C38H58N8O14/c1-7-19(4)31(36(57)43-24(15-27(39)49)34(55)42-25(16-30(52)53)35(56)44-26(38(59)60)14-18(2)3)46-37(58)32(21(6)47)45-29(51)17-40-33(54)20(5)41-28(50)13-10-22-8-11-23(48)12-9-22/h8-9,11-12,18-21,24-26,31-32,47-48H,7,10,13-17H2,1-6H3,(H2,39,49)(H,40,54)(H,41,50)(H,42,55)(H,43,57)(H,44,56)(H,45,51)(H,46,58)(H,52,53)(H,59,60)/t19-,20-,21?,24-,25-,26-,31-,32-/m0/s1
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n/an/a 1.30E+4n/an/an/an/an/an/a



Notre-Dame Hospital Research

Curated by ChEMBL


Assay Description
Inhibitory activity was determined against HSV-1 Ribonucleoside diphosphate reductase


J Med Chem 33: 723-30 (1990)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50366468
PNG
(CHEMBL1790768)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@H](C)O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(O)=O
Show InChI InChI=1S/C43H68N10O15/c1-9-21(6)34(41(65)49-27(16-30(45)56)38(62)48-28(17-32(58)59)39(63)50-29(43(67)68)14-19(2)3)53-40(64)33(20(4)5)52-42(66)35(23(8)54)51-31(57)18-46-36(60)22(7)47-37(61)26(44)15-24-10-12-25(55)13-11-24/h10-13,19-23,26-29,33-35,54-55H,9,14-18,44H2,1-8H3,(H2,45,56)(H,46,60)(H,47,61)(H,48,62)(H,49,65)(H,50,63)(H,51,57)(H,52,66)(H,53,64)(H,58,59)(H,67,68)/t21-,22-,23-,26-,27-,28-,29-,33-,34-,35-/m0/s1
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n/an/a 1.50E+4n/an/an/an/an/an/a



Notre-Dame Hospital Research

Curated by ChEMBL


Assay Description
Inhibitory activity was determined against HSV-1 Ribonucleoside diphosphate reductase


J Med Chem 33: 723-30 (1990)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50013353
PNG
(CHEMBL2371374 | Thr-Asp-Phe-Phe-Glu-Cys-Arg-Ser-Th...)
Show SMILES CC(C)CC(NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(=O)[C@@H](N)C(C)O)[C@@H](C)O)C(C)C)C(C)C)C(O)=O
Show InChI InChI=1S/C91H135N23O32S/c1-41(2)30-60(90(145)146)108-82(137)58(35-67(124)125)105-80(135)57(34-64(92)120)107-87(142)70(42(3)4)113-88(143)71(43(5)6)112-74(129)45(8)98-65(121)37-97-73(128)44(7)99-77(132)54(33-50-23-25-51(119)26-24-50)104-83(138)61(38-115)110-89(144)72(47(10)118)114-84(139)62(39-116)109-75(130)52(22-17-29-96-91(94)95)100-85(140)63(40-147)111-76(131)53(27-28-66(122)123)101-78(133)55(31-48-18-13-11-14-19-48)102-79(134)56(32-49-20-15-12-16-21-49)103-81(136)59(36-68(126)127)106-86(141)69(93)46(9)117/h11-16,18-21,23-26,41-47,52-63,69-72,115-119,147H,17,22,27-40,93H2,1-10H3,(H2,92,120)(H,97,128)(H,98,121)(H,99,132)(H,100,140)(H,101,133)(H,102,134)(H,103,136)(H,104,138)(H,105,135)(H,106,141)(H,107,142)(H,108,137)(H,109,130)(H,110,144)(H,111,131)(H,112,129)(H,113,143)(H,114,139)(H,122,123)(H,124,125)(H,126,127)(H,145,146)(H4,94,95,96)/t44-,45-,46?,47+,52-,53-,54-,55-,56-,57-,58-,59-,60?,61-,62-,63-,69-,70-,71-,72-/m0/s1
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n/an/a 1.50E+4n/an/an/an/an/an/a



Notre-Dame Hospital Research

Curated by ChEMBL


Assay Description
Inhibitory activity was determined against HSV-1 Ribonucleoside diphosphate reductase


J Med Chem 33: 723-30 (1990)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50013353
PNG
(CHEMBL2371374 | Thr-Asp-Phe-Phe-Glu-Cys-Arg-Ser-Th...)
Show SMILES CC(C)CC(NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CS)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(=O)[C@@H](N)C(C)O)[C@@H](C)O)C(C)C)C(C)C)C(O)=O
Show InChI InChI=1S/C91H135N23O32S/c1-41(2)30-60(90(145)146)108-82(137)58(35-67(124)125)105-80(135)57(34-64(92)120)107-87(142)70(42(3)4)113-88(143)71(43(5)6)112-74(129)45(8)98-65(121)37-97-73(128)44(7)99-77(132)54(33-50-23-25-51(119)26-24-50)104-83(138)61(38-115)110-89(144)72(47(10)118)114-84(139)62(39-116)109-75(130)52(22-17-29-96-91(94)95)100-85(140)63(40-147)111-76(131)53(27-28-66(122)123)101-78(133)55(31-48-18-13-11-14-19-48)102-79(134)56(32-49-20-15-12-16-21-49)103-81(136)59(36-68(126)127)106-86(141)69(93)46(9)117/h11-16,18-21,23-26,41-47,52-63,69-72,115-119,147H,17,22,27-40,93H2,1-10H3,(H2,92,120)(H,97,128)(H,98,121)(H,99,132)(H,100,140)(H,101,133)(H,102,134)(H,103,136)(H,104,138)(H,105,135)(H,106,141)(H,107,142)(H,108,137)(H,109,130)(H,110,144)(H,111,131)(H,112,129)(H,113,143)(H,114,139)(H,122,123)(H,124,125)(H,126,127)(H,145,146)(H4,94,95,96)/t44-,45-,46?,47+,52-,53-,54-,55-,56-,57-,58-,59-,60?,61-,62-,63-,69-,70-,71-,72-/m0/s1
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n/an/a 1.50E+4n/an/an/an/an/an/a



Notre-Dame Hospital Research

Curated by ChEMBL


Assay Description
Inhibitory activity was determined against HSV-1 Ribonucleoside diphosphate reductase


J Med Chem 33: 723-30 (1990)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50013371
PNG
(Ac-Tyr-Ala-Gly-Ala-Val-Val-Asn-Asp-Leu | CHEMBL434...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(C)C)C(C)C)C(O)=O
Show InChI InChI=1S/C43H66N10O15/c1-19(2)14-30(43(67)68)51-40(64)29(17-33(58)59)49-39(63)28(16-31(44)56)50-41(65)34(20(3)4)53-42(66)35(21(5)6)52-37(61)23(8)46-32(57)18-45-36(60)22(7)47-38(62)27(48-24(9)54)15-25-10-12-26(55)13-11-25/h10-13,19-23,27-30,34-35,55H,14-18H2,1-9H3,(H2,44,56)(H,45,60)(H,46,57)(H,47,62)(H,48,54)(H,49,63)(H,50,65)(H,51,64)(H,52,61)(H,53,66)(H,58,59)(H,67,68)/t22-,23-,27-,28-,29-,30-,34-,35-/m0/s1
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n/an/a 2.00E+4n/an/an/an/an/an/a



Notre-Dame Hospital Research

Curated by ChEMBL


Assay Description
Inhibitory activity was determined against HSV-1 Ribonucleoside diphosphate reductase


J Med Chem 33: 723-30 (1990)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50013357
PNG
(CHEMBL412159 | Ser-Thr-Ser-Tyr-Ala-Gly-Ala-Val-Val...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)O)C(C)C)C(C)C)C(O)=O
Show InChI InChI=1S/C51H81N13O20/c1-21(2)14-33(51(83)84)60-46(78)32(17-37(71)72)58-45(77)31(16-35(53)69)59-48(80)38(22(3)4)63-49(81)39(23(5)6)62-42(74)25(8)55-36(70)18-54-41(73)24(7)56-44(76)30(15-27-10-12-28(68)13-11-27)57-47(79)34(20-66)61-50(82)40(26(9)67)64-43(75)29(52)19-65/h10-13,21-26,29-34,38-40,65-68H,14-20,52H2,1-9H3,(H2,53,69)(H,54,73)(H,55,70)(H,56,76)(H,57,79)(H,58,77)(H,59,80)(H,60,78)(H,61,82)(H,62,74)(H,63,81)(H,64,75)(H,71,72)(H,83,84)/t24-,25-,26+,29-,30-,31-,32-,33-,34-,38-,39-,40-/m0/s1
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n/an/a 2.90E+4n/an/an/an/an/an/a



Notre-Dame Hospital Research

Curated by ChEMBL


Assay Description
Inhibitory activity was determined against HSV-1 Ribonucleoside diphosphate reductase


J Med Chem 33: 723-30 (1990)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50013345
PNG
(CHEMBL423453 | desamino-Tyr-Ala-Gly-Ala-Val-Val-As...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](C)NC(=O)CCc1ccc(O)cc1)C(C)C)C(C)C)C(O)=O
Show InChI InChI=1S/C41H63N9O14/c1-19(2)15-28(41(63)64)48-38(60)27(17-32(55)56)46-37(59)26(16-29(42)52)47-39(61)33(20(3)4)50-40(62)34(21(5)6)49-36(58)23(8)45-31(54)18-43-35(57)22(7)44-30(53)14-11-24-9-12-25(51)13-10-24/h9-10,12-13,19-23,26-28,33-34,51H,11,14-18H2,1-8H3,(H2,42,52)(H,43,57)(H,44,53)(H,45,54)(H,46,59)(H,47,61)(H,48,60)(H,49,58)(H,50,62)(H,55,56)(H,63,64)/t22-,23-,26-,27-,28-,33-,34-/m0/s1
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n/an/a 3.30E+4n/an/an/an/an/an/a



Notre-Dame Hospital Research

Curated by ChEMBL


Assay Description
Inhibitory activity was determined against HSV-1 Ribonucleoside diphosphate reductase


J Med Chem 33: 723-30 (1990)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50013384
PNG
(CHEMBL2371367 | Tyr-Ala-Gly-Ala-Val-Ile-Asn-Asp-Le...)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(O)=O
Show InChI InChI=1S/C42H66N10O14/c1-9-21(6)34(41(64)49-27(16-30(44)54)38(61)48-28(17-32(56)57)39(62)50-29(42(65)66)14-19(2)3)52-40(63)33(20(4)5)51-36(59)23(8)46-31(55)18-45-35(58)22(7)47-37(60)26(43)15-24-10-12-25(53)13-11-24/h10-13,19-23,26-29,33-34,53H,9,14-18,43H2,1-8H3,(H2,44,54)(H,45,58)(H,46,55)(H,47,60)(H,48,61)(H,49,64)(H,50,62)(H,51,59)(H,52,63)(H,56,57)(H,65,66)/t21-,22-,23-,26-,27-,28-,29-,33-,34-/m0/s1
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n/an/a 3.30E+4n/an/an/an/an/an/a



Notre-Dame Hospital Research

Curated by ChEMBL


Assay Description
Inhibitory activity was determined against HSV-1 Ribonucleoside diphosphate reductase


J Med Chem 33: 723-30 (1990)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50013372
PNG
(CHEMBL2371373 | Tyr-Thr-Met-Leu-Val-Val-Asn-Asp-Le...)
Show SMILES CSCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(O)=O
Show InChI InChI=1S/C48H77N9O16S/c1-22(2)17-31(51-41(65)30(15-16-74-10)50-47(71)39(26(9)58)57-40(64)29(49)19-27-11-13-28(59)14-12-27)44(68)55-38(25(7)8)46(70)56-37(24(5)6)45(69)53-33(21-36(62)63)42(66)52-32(20-35(60)61)43(67)54-34(48(72)73)18-23(3)4/h11-14,22-26,29-34,37-39,58-59H,15-21,49H2,1-10H3,(H,50,71)(H,51,65)(H,52,66)(H,53,69)(H,54,67)(H,55,68)(H,56,70)(H,57,64)(H,60,61)(H,62,63)(H,72,73)/t26-,29+,30+,31+,32+,33+,34+,37+,38+,39+/m1/s1
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n/an/a 3.60E+4n/an/an/an/an/an/a



Notre-Dame Hospital Research

Curated by ChEMBL


Assay Description
Inhibitory activity against HSV-1 Ribonucleoside diphosphate reductase was determined


J Med Chem 33: 723-30 (1990)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50013381
PNG
(Ala-Gly-Ala-Val-Val-Asn-Asp-Leu | CHEMBL103140 | H...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](C)N)C(C)C)C(C)C)C(O)=O
Show InChI InChI=1S/C32H55N9O12/c1-13(2)9-20(32(52)53)39-29(49)19(11-23(44)45)37-28(48)18(10-21(34)42)38-30(50)24(14(3)4)41-31(51)25(15(5)6)40-27(47)17(8)36-22(43)12-35-26(46)16(7)33/h13-20,24-25H,9-12,33H2,1-8H3,(H2,34,42)(H,35,46)(H,36,43)(H,37,48)(H,38,50)(H,39,49)(H,40,47)(H,41,51)(H,44,45)(H,52,53)/t16-,17-,18-,19-,20-,24-,25-/m0/s1
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n/an/a 3.60E+4n/an/an/an/an/an/a



Notre-Dame Hospital Research

Curated by ChEMBL


Assay Description
Inhibitory activity against HSV-1 Ribonucleoside diphosphate reductase was determined


J Med Chem 33: 723-30 (1990)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50013366
PNG
((S)-2-[(S)-2-((S)-2-{(S)-2-[(S)-2-((S)-2-Amino-pro...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)N)C(C)C)C(C)C)C(O)=O
Show InChI InChI=1S/C27H47N7O10/c1-11(2)8-17(27(43)44)32-24(40)16(10-19(36)37)30-23(39)15(9-18(29)35)31-25(41)20(12(3)4)34-26(42)21(13(5)6)33-22(38)14(7)28/h11-17,20-21H,8-10,28H2,1-7H3,(H2,29,35)(H,30,39)(H,31,41)(H,32,40)(H,33,38)(H,34,42)(H,36,37)(H,43,44)/t14-,15-,16-,17-,20-,21-/m0/s1
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n/an/a 3.60E+4n/an/an/an/an/an/a



Notre-Dame Hospital Research

Curated by ChEMBL


Assay Description
Inhibitory activity against HSV-1 Ribonucleoside diphosphate reductase was determined


J Med Chem 33: 723-30 (1990)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50013354
PNG
(CHEMBL409888 | Gly-Ala-Val-Val-Asn-Asp-Leu | H-Gly...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CN)C(C)C)C(C)C)C(O)=O
Show InChI InChI=1S/C29H50N8O11/c1-12(2)8-18(29(47)48)35-26(44)17(10-21(40)41)33-25(43)16(9-19(31)38)34-27(45)22(13(3)4)37-28(46)23(14(5)6)36-24(42)15(7)32-20(39)11-30/h12-18,22-23H,8-11,30H2,1-7H3,(H2,31,38)(H,32,39)(H,33,43)(H,34,45)(H,35,44)(H,36,42)(H,37,46)(H,40,41)(H,47,48)/t15-,16-,17-,18-,22-,23-/m0/s1
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n/an/a 3.60E+4n/an/an/an/an/an/a



Notre-Dame Hospital Research

Curated by ChEMBL


Assay Description
Inhibitory activity against HSV-1 Ribonucleoside diphosphate reductase was determined


J Med Chem 33: 723-30 (1990)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50013358
PNG
(CHEMBL102379 | H-Val-Val-Asn-Asp-Leu-OH | Val-Val-...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](N)C(C)C)C(C)C)C(O)=O
Show InChI InChI=1S/C24H42N6O9/c1-10(2)7-15(24(38)39)29-21(35)14(9-17(32)33)27-20(34)13(8-16(25)31)28-23(37)19(12(5)6)30-22(36)18(26)11(3)4/h10-15,18-19H,7-9,26H2,1-6H3,(H2,25,31)(H,27,34)(H,28,37)(H,29,35)(H,30,36)(H,32,33)(H,38,39)/t13-,14-,15-,18-,19-/m0/s1
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n/an/a 3.60E+4n/an/an/an/an/an/a



Notre-Dame Hospital Research

Curated by ChEMBL


Assay Description
Inhibitory activity against HSV-1 Ribonucleoside diphosphate reductase was determined


J Med Chem 33: 723-30 (1990)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50013376
PNG
(CHEMBL351838 | Tyr-Ala-Pro-Ala-Val-Val-Asn-Asp-Leu)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(C)C)C(C)C)C(O)=O
Show InChI InChI=1S/C44H68N10O14/c1-20(2)16-30(44(67)68)51-39(62)29(19-33(57)58)49-38(61)28(18-32(46)56)50-41(64)34(21(3)4)53-42(65)35(22(5)6)52-36(59)23(7)47-40(63)31-10-9-15-54(31)43(66)24(8)48-37(60)27(45)17-25-11-13-26(55)14-12-25/h11-14,20-24,27-31,34-35,55H,9-10,15-19,45H2,1-8H3,(H2,46,56)(H,47,63)(H,48,60)(H,49,61)(H,50,64)(H,51,62)(H,52,59)(H,53,65)(H,57,58)(H,67,68)/t23-,24-,27-,28-,29-,30-,31-,34-,35-/m0/s1
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n/an/a 3.70E+4n/an/an/an/an/an/a



Notre-Dame Hospital Research

Curated by ChEMBL


Assay Description
Inhibitory activity was determined against HSV-1 Ribonucleoside diphosphate reductase


J Med Chem 33: 723-30 (1990)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50013362
PNG
(Ac-Tyr(OMe)-Ala-Gly-Ala-Val-Val-Asn-Asp-Leu | CHEM...)
Show SMILES COc1ccc(C[C@H](NC(C)=O)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(O)=O)cc1
Show InChI InChI=1S/C44H68N10O15/c1-20(2)15-31(44(67)68)52-41(64)30(18-34(58)59)50-40(63)29(17-32(45)56)51-42(65)35(21(3)4)54-43(66)36(22(5)6)53-38(61)24(8)47-33(57)19-46-37(60)23(7)48-39(62)28(49-25(9)55)16-26-11-13-27(69-10)14-12-26/h11-14,20-24,28-31,35-36H,15-19H2,1-10H3,(H2,45,56)(H,46,60)(H,47,57)(H,48,62)(H,49,55)(H,50,63)(H,51,65)(H,52,64)(H,53,61)(H,54,66)(H,58,59)(H,67,68)/t23-,24-,28-,29-,30-,31-,35-,36-/m0/s1
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n/an/a 4.00E+4n/an/an/an/an/an/a



Notre-Dame Hospital Research

Curated by ChEMBL


Assay Description
Inhibitory activity was determined against HSV-1 Ribonucleoside diphosphate reductase


J Med Chem 33: 723-30 (1990)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50050820
PNG
((S)-2-[(S)-3-Carboxy-2-((S)-2-{2-[3-(1-ethyl-propy...)
Show SMILES CCC(CC)NC(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N1CCCC1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(O)=O
Show InChI InChI=1S/C27H46N6O9/c1-6-17(7-2)29-27(42)28-16(5)23(37)30-18(13-21(34)33-10-8-9-11-33)24(38)31-19(14-22(35)36)25(39)32-20(26(40)41)12-15(3)4/h15-20H,6-14H2,1-5H3,(H,30,37)(H,31,38)(H,32,39)(H,35,36)(H,40,41)(H2,28,29,42)/t16-,18-,19-,20-/m0/s1
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n/an/a 4.10E+4n/an/an/an/an/an/a



Bio-Méga/Boehringer Ingelheim Research Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Herpes simplex virus (HSV) ribonucleotide reductase (RR)


Citation and Details
More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50013364
PNG
(CHEMBL2371380 | Glu-Cys-Arg-Ser-Thr-Ser-Tyr-Ala-Gl...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CS)NC(=O)[C@@H](N)CCC(O)=O)[C@@H](C)O)C(C)C)C(C)C)C(O)=O
Show InChI InChI=1S/C65H105N19O25S/c1-27(2)19-40(64(108)109)78-57(101)39(22-47(93)94)76-56(100)38(21-44(67)89)77-61(105)48(28(3)4)83-62(106)49(29(5)6)82-52(96)31(8)72-45(90)23-71-51(95)30(7)73-55(99)37(20-33-12-14-34(88)15-13-33)75-58(102)41(24-85)80-63(107)50(32(9)87)84-59(103)42(25-86)79-54(98)36(11-10-18-70-65(68)69)74-60(104)43(26-110)81-53(97)35(66)16-17-46(91)92/h12-15,27-32,35-43,48-50,85-88,110H,10-11,16-26,66H2,1-9H3,(H2,67,89)(H,71,95)(H,72,90)(H,73,99)(H,74,104)(H,75,102)(H,76,100)(H,77,105)(H,78,101)(H,79,98)(H,80,107)(H,81,97)(H,82,96)(H,83,106)(H,84,103)(H,91,92)(H,93,94)(H,108,109)(H4,68,69,70)/t30-,31-,32+,35-,36-,37-,38-,39-,40-,41-,42-,43-,48-,49-,50-/m0/s1
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n/an/a 4.20E+4n/an/an/an/an/an/a



Notre-Dame Hospital Research

Curated by ChEMBL


Assay Description
Inhibitory activity was determined against HSV-1 Ribonucleoside diphosphate reductase


J Med Chem 33: 723-30 (1990)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50050827
PNG
((S)-2-((S)-3-Carboxy-2-{(S)-2-[(S)-3-methyl-2-(3-m...)
Show SMILES CNC(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(=O)N1CCCC1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(O)=O
Show InChI InChI=1S/C25H42N6O9/c1-13(2)10-17(24(38)39)29-22(36)16(12-19(33)34)27-21(35)15(11-18(32)31-8-6-7-9-31)28-23(37)20(14(3)4)30-25(40)26-5/h13-17,20H,6-12H2,1-5H3,(H,27,35)(H,28,37)(H,29,36)(H,33,34)(H,38,39)(H2,26,30,40)/t15-,16-,17-,20-/m0/s1
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n/an/a 4.20E+4n/an/an/an/an/an/a



Bio-Méga/Boehringer Ingelheim Research Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Herpes simplex virus (HSV) ribonucleotide reductase (RR)


Citation and Details
More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50013377
PNG
(CHEMBL2371369 | desamino-Tyr-Ala-Gly-Thr-Ile-Asn-A...)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](C)NC(=O)CCc1ccc(O)cc1)C(C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(O)=O
Show InChI InChI=1S/C38H58N8O14/c1-7-19(4)31(36(57)43-24(15-27(39)49)34(55)42-25(16-30(52)53)35(56)44-26(38(59)60)14-18(2)3)46-37(58)32(21(6)47)45-29(51)17-40-33(54)20(5)41-28(50)13-10-22-8-11-23(48)12-9-22/h8-9,11-12,18-21,24-26,31-32,47-48H,7,10,13-17H2,1-6H3,(H2,39,49)(H,40,54)(H,41,50)(H,42,55)(H,43,57)(H,44,56)(H,45,51)(H,46,58)(H,52,53)(H,59,60)/t19-,20-,21?,24-,25-,26-,31-,32-/m0/s1
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n/an/a 4.20E+4n/an/an/an/an/an/a



Notre-Dame Hospital Research

Curated by ChEMBL


Assay Description
Inhibitory activity against HSV-1 Ribonucleoside diphosphate reductase was determined


J Med Chem 33: 723-30 (1990)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50013383
PNG
(CHEMBL350585 | Tyr-C8-Val-Val-Asn-Asp-Leu)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NCCCCCCCCOC(=O)[C@@H](N)Cc1ccc(O)cc1)C(C)C)C(C)C)C(O)=O
Show InChI InChI=1S/C41H67N7O12/c1-23(2)19-31(40(57)58)47-37(54)30(22-33(51)52)45-36(53)29(21-32(43)50)46-39(56)35(25(5)6)48-38(55)34(24(3)4)44-17-11-9-7-8-10-12-18-60-41(59)28(42)20-26-13-15-27(49)16-14-26/h13-16,23-25,28-31,34-35,44,49H,7-12,17-22,42H2,1-6H3,(H2,43,50)(H,45,53)(H,46,56)(H,47,54)(H,48,55)(H,51,52)(H,57,58)/t28-,29-,30-,31-,34-,35-/m0/s1
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n/an/a 4.40E+4n/an/an/an/an/an/a



Notre-Dame Hospital Research

Curated by ChEMBL


Assay Description
Inhibitory activity against HSV-1 Ribonucleoside diphosphate reductase was determined


J Med Chem 33: 723-30 (1990)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50013347
PNG
(CHEMBL387456 | H2N-C8-Tyr-Ala-Gly-Ala-Val-Val-Asn-...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NCCCCCCCCN)C(C)C)C(C)C)C(O)=O
Show InChI InChI=1S/C49H81N11O14/c1-26(2)21-36(49(73)74)58-46(70)35(24-39(64)65)56-45(69)34(23-37(51)62)57-47(71)40(27(3)4)60-48(72)41(28(5)6)59-43(67)30(8)54-38(63)25-53-42(66)29(7)55-44(68)33(22-31-15-17-32(61)18-16-31)52-20-14-12-10-9-11-13-19-50/h15-18,26-30,33-36,40-41,52,61H,9-14,19-25,50H2,1-8H3,(H2,51,62)(H,53,66)(H,54,63)(H,55,68)(H,56,69)(H,57,71)(H,58,70)(H,59,67)(H,60,72)(H,64,65)(H,73,74)/t29-,30-,33-,34-,35-,36-,40-,41-/m0/s1
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n/an/a 4.40E+4n/an/an/an/an/an/a



Notre-Dame Hospital Research

Curated by ChEMBL


Assay Description
Inhibitory activity against HSV-1 Ribonucleoside diphosphate reductase was determined


J Med Chem 33: 723-30 (1990)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50013370
PNG
(CHEMBL2371362 | Tyr-Ala-Gly-Thr-Val-Val-Asn-Asp-Le...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(C)C)C(C)C)C(O)=O
Show InChI InChI=1S/C42H66N10O15/c1-18(2)13-28(42(66)67)49-38(62)27(16-31(57)58)47-37(61)26(15-29(44)55)48-39(63)32(19(3)4)51-40(64)33(20(5)6)52-41(65)34(22(8)53)50-30(56)17-45-35(59)21(7)46-36(60)25(43)14-23-9-11-24(54)12-10-23/h9-12,18-22,25-28,32-34,53-54H,13-17,43H2,1-8H3,(H2,44,55)(H,45,59)(H,46,60)(H,47,61)(H,48,63)(H,49,62)(H,50,56)(H,51,64)(H,52,65)(H,57,58)(H,66,67)/t21-,22+,25-,26-,27-,28-,32-,33-,34-/m0/s1
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n/an/a 4.40E+4n/an/an/an/an/an/a



Notre-Dame Hospital Research

Curated by ChEMBL


Assay Description
Inhibitory activity against HSV-1 Ribonucleoside diphosphate reductase was determined


J Med Chem 33: 723-30 (1990)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50013370
PNG
(CHEMBL2371362 | Tyr-Ala-Gly-Thr-Val-Val-Asn-Asp-Le...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(C)C)C(C)C)C(O)=O
Show InChI InChI=1S/C42H66N10O15/c1-18(2)13-28(42(66)67)49-38(62)27(16-31(57)58)47-37(61)26(15-29(44)55)48-39(63)32(19(3)4)51-40(64)33(20(5)6)52-41(65)34(22(8)53)50-30(56)17-45-35(59)21(7)46-36(60)25(43)14-23-9-11-24(54)12-10-23/h9-12,18-22,25-28,32-34,53-54H,13-17,43H2,1-8H3,(H2,44,55)(H,45,59)(H,46,60)(H,47,61)(H,48,63)(H,49,62)(H,50,56)(H,51,64)(H,52,65)(H,57,58)(H,66,67)/t21-,22+,25-,26-,27-,28-,32-,33-,34-/m0/s1
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n/an/a 4.40E+4n/an/an/an/an/an/a



Notre-Dame Hospital Research

Curated by ChEMBL


Assay Description
Inhibitory activity against HSV-1 Ribonucleoside diphosphate reductase was determined


J Med Chem 33: 723-30 (1990)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50013376
PNG
(CHEMBL351838 | Tyr-Ala-Pro-Ala-Val-Val-Asn-Asp-Leu)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(C)C)C(C)C)C(O)=O
Show InChI InChI=1S/C44H68N10O14/c1-20(2)16-30(44(67)68)51-39(62)29(19-33(57)58)49-38(61)28(18-32(46)56)50-41(64)34(21(3)4)53-42(65)35(22(5)6)52-36(59)23(7)47-40(63)31-10-9-15-54(31)43(66)24(8)48-37(60)27(45)17-25-11-13-26(55)14-12-25/h11-14,20-24,27-31,34-35,55H,9-10,15-19,45H2,1-8H3,(H2,46,56)(H,47,63)(H,48,60)(H,49,61)(H,50,64)(H,51,62)(H,52,59)(H,53,65)(H,57,58)(H,67,68)/t23-,24-,27-,28-,29-,30-,31-,34-,35-/m0/s1
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n/an/a 4.40E+4n/an/an/an/an/an/a



Notre-Dame Hospital Research

Curated by ChEMBL


Assay Description
Inhibitory activity against HSV-1 Ribonucleoside diphosphate reductase was determined


J Med Chem 33: 723-30 (1990)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50013363
PNG
(CHEMBL351165 | Tyr-Ala-Gly-Pro-Val-Val-Asn-Asp-Leu)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(C)C)C(C)C)C(O)=O
Show InChI InChI=1S/C43H66N10O14/c1-20(2)15-29(43(66)67)50-39(62)28(18-33(57)58)48-38(61)27(17-31(45)55)49-41(64)34(21(3)4)52-42(65)35(22(5)6)51-40(63)30-9-8-14-53(30)32(56)19-46-36(59)23(7)47-37(60)26(44)16-24-10-12-25(54)13-11-24/h10-13,20-23,26-30,34-35,54H,8-9,14-19,44H2,1-7H3,(H2,45,55)(H,46,59)(H,47,60)(H,48,61)(H,49,64)(H,50,62)(H,51,63)(H,52,65)(H,57,58)(H,66,67)/t23-,26-,27-,28-,29-,30-,34-,35-/m0/s1
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n/an/a 4.40E+4n/an/an/an/an/an/a



Notre-Dame Hospital Research

Curated by ChEMBL


Assay Description
Inhibitory activity against HSV-1 Ribonucleoside diphosphate reductase was determined


J Med Chem 33: 723-30 (1990)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50013363
PNG
(CHEMBL351165 | Tyr-Ala-Gly-Pro-Val-Val-Asn-Asp-Leu)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(C)C)C(C)C)C(O)=O
Show InChI InChI=1S/C43H66N10O14/c1-20(2)15-29(43(66)67)50-39(62)28(18-33(57)58)48-38(61)27(17-31(45)55)49-41(64)34(21(3)4)52-42(65)35(22(5)6)51-40(63)30-9-8-14-53(30)32(56)19-46-36(59)23(7)47-37(60)26(44)16-24-10-12-25(54)13-11-24/h10-13,20-23,26-30,34-35,54H,8-9,14-19,44H2,1-7H3,(H2,45,55)(H,46,59)(H,47,60)(H,48,61)(H,49,64)(H,50,62)(H,51,63)(H,52,65)(H,57,58)(H,66,67)/t23-,26-,27-,28-,29-,30-,34-,35-/m0/s1
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n/an/a 4.80E+4n/an/an/an/an/an/a



Notre-Dame Hospital Research

Curated by ChEMBL


Assay Description
Inhibitory activity was determined against HSV-1 Ribonucleoside diphosphate reductase


J Med Chem 33: 723-30 (1990)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50013384
PNG
(CHEMBL2371367 | Tyr-Ala-Gly-Ala-Val-Ile-Asn-Asp-Le...)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(O)=O
Show InChI InChI=1S/C42H66N10O14/c1-9-21(6)34(41(64)49-27(16-30(44)54)38(61)48-28(17-32(56)57)39(62)50-29(42(65)66)14-19(2)3)52-40(63)33(20(4)5)51-36(59)23(8)46-31(55)18-45-35(58)22(7)47-37(60)26(43)15-24-10-12-25(53)13-11-24/h10-13,19-23,26-29,33-34,53H,9,14-18,43H2,1-8H3,(H2,44,54)(H,45,58)(H,46,55)(H,47,60)(H,48,61)(H,49,64)(H,50,62)(H,51,59)(H,52,63)(H,56,57)(H,65,66)/t21-,22-,23-,26-,27-,28-,29-,33-,34-/m0/s1
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n/an/a 4.90E+4n/an/an/an/an/an/a



Notre-Dame Hospital Research

Curated by ChEMBL


Assay Description
Inhibitory activity against HSV-1 Ribonucleoside diphosphate reductase was determined


J Med Chem 33: 723-30 (1990)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50013356
PNG
(CHEMBL162068 | D-Tyr-Ala-Gly-Ala-Val-Val-Asn-Asp-L...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](N)Cc1ccc(O)cc1)C(C)C)C(C)C)C(O)=O
Show InChI InChI=1S/C41H64N10O14/c1-18(2)13-28(41(64)65)49-38(61)27(16-31(55)56)47-37(60)26(15-29(43)53)48-39(62)32(19(3)4)51-40(63)33(20(5)6)50-35(58)22(8)45-30(54)17-44-34(57)21(7)46-36(59)25(42)14-23-9-11-24(52)12-10-23/h9-12,18-22,25-28,32-33,52H,13-17,42H2,1-8H3,(H2,43,53)(H,44,57)(H,45,54)(H,46,59)(H,47,60)(H,48,62)(H,49,61)(H,50,58)(H,51,63)(H,55,56)(H,64,65)/t21-,22-,25+,26-,27-,28-,32-,33-/m0/s1
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n/an/a 5.00E+4n/an/an/an/an/an/a



Notre-Dame Hospital Research

Curated by ChEMBL


Assay Description
Inhibitory activity against HSV-1 Ribonucleoside diphosphate reductase was determined


J Med Chem 33: 723-30 (1990)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50013378
PNG
(CHEMBL434294 | Phe-Ala-Gly-Ala-Val-Val-Asn-Asp-Leu)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccccc1)C(C)C)C(C)C)C(O)=O
Show InChI InChI=1S/C41H64N10O13/c1-19(2)14-28(41(63)64)49-38(60)27(17-31(54)55)47-37(59)26(16-29(43)52)48-39(61)32(20(3)4)51-40(62)33(21(5)6)50-35(57)23(8)45-30(53)18-44-34(56)22(7)46-36(58)25(42)15-24-12-10-9-11-13-24/h9-13,19-23,25-28,32-33H,14-18,42H2,1-8H3,(H2,43,52)(H,44,56)(H,45,53)(H,46,58)(H,47,59)(H,48,61)(H,49,60)(H,50,57)(H,51,62)(H,54,55)(H,63,64)/t22-,23-,25-,26-,27-,28-,32-,33-/m0/s1
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n/an/a 5.50E+4n/an/an/an/an/an/a



Notre-Dame Hospital Research

Curated by ChEMBL


Assay Description
Inhibitory activity against HSV-1 Ribonucleoside diphosphate reductase was determined


J Med Chem 33: 723-30 (1990)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50013373
PNG
(CHEMBL350125 | His-Ala-Gly-Ala-Val-Val-Asn-Asp-Leu)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(C)C)C(C)C)C(O)=O
Show InChI InChI=1S/C38H62N12O13/c1-16(2)9-25(38(62)63)48-35(59)24(12-28(53)54)46-34(58)23(11-26(40)51)47-36(60)29(17(3)4)50-37(61)30(18(5)6)49-32(56)20(8)44-27(52)14-42-31(55)19(7)45-33(57)22(39)10-21-13-41-15-43-21/h13,15-20,22-25,29-30H,9-12,14,39H2,1-8H3,(H2,40,51)(H,41,43)(H,42,55)(H,44,52)(H,45,57)(H,46,58)(H,47,60)(H,48,59)(H,49,56)(H,50,61)(H,53,54)(H,62,63)/t19-,20-,22-,23-,24-,25-,29-,30-/m0/s1
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Notre-Dame Hospital Research

Curated by ChEMBL


Assay Description
Inhibitory activity against HSV-1 Ribonucleoside diphosphate reductase was determined


J Med Chem 33: 723-30 (1990)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase large chain


(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...)
BDBM50013355
PNG
(CHEMBL265148 | Tyr-Ala-Gly-Ala-Val-Val-Asn-Asp-Leu...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(C)C)C(C)C)C(=O)N[C@@H](CCCCN)C(O)=O
Show InChI InChI=1S/C47H76N12O15/c1-22(2)17-31(42(68)54-30(47(73)74)11-9-10-16-48)55-44(70)33(20-36(63)64)56-43(69)32(19-34(50)61)57-45(71)37(23(3)4)59-46(72)38(24(5)6)58-40(66)26(8)52-35(62)21-51-39(65)25(7)53-41(67)29(49)18-27-12-14-28(60)15-13-27/h12-15,22-26,29-33,37-38,60H,9-11,16-21,48-49H2,1-8H3,(H2,50,61)(H,51,65)(H,52,62)(H,53,67)(H,54,68)(H,55,70)(H,56,69)(H,57,71)(H,58,66)(H,59,72)(H,63,64)(H,73,74)/t25-,26-,29-,30-,31-,32-,33-,37-,38-/m0/s1
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n/an/a 5.50E+4n/an/an/an/an/an/a



Notre-Dame Hospital Research

Curated by ChEMBL


Assay Description
Inhibitory activity against HSV-1 Ribonucleoside diphosphate reductase was determined


J Med Chem 33: 723-30 (1990)

More data for this
Ligand-Target Pair
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