Found 115 hits with Last Name = 'brazeau' and Initial = 'p' 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 |
|---|
Ribonucleoside-diphosphate reductase large subunit
(Homo sapiens (Human)) | BDBM50000150
(CHEMBL440253 | Ribonucleotide reductase inhibiting...)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](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccc(cc1)[N+]([O-])=O)NC(C)=O)[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/C54H78N12O19/c1-10-27(6)44(52(80)61-37(22-40(55)70)49(77)60-38(23-42(72)73)50(78)62-39(54(82)83)19-25(2)3)65-51(79)43(26(4)5)64-53(81)45(29(8)67)63-41(71)24-56-46(74)28(7)57-47(75)36(21-32-13-17-34(69)18-14-32)59-48(76)35(58-30(9)68)20-31-11-15-33(16-12-31)66(84)85/h11-18,25-29,35-39,43-45,67,69H,10,19-24H2,1-9H3,(H2,55,70)(H,56,74)(H,57,75)(H,58,68)(H,59,76)(H,60,77)(H,61,80)(H,62,78)(H,63,71)(H,64,81)(H,65,79)(H,72,73)(H,82,83)/t27-,28+,29-,35+,36+,37+,38+,39+,43+,44+,45+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 1.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Notre-Dame Hospital Research
Curated by ChEMBL
| Assay Description
Inhibitory concentration against HSV-1 ribonucleotide reductase R1 protein binding |
J Med Chem 35: 346-50 (1992)
BindingDB Entry DOI: 10.7270/Q2348JB2 |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Homo sapiens (Human)) | BDBM50000141
(2-{2-[2-(2-{2-[2-(2-{2-[2-Acetylamino-3-(1H-indol-...)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](Cc1c[nH]c2ccccc12)NC(C)=O)[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/C47H71N11O15/c1-10-23(6)38(45(70)54-31(17-34(48)61)42(67)53-32(18-36(63)64)43(68)55-33(47(72)73)15-21(2)3)58-44(69)37(22(4)5)57-46(71)39(25(8)59)56-35(62)20-50-40(65)24(7)51-41(66)30(52-26(9)60)16-27-19-49-29-14-12-11-13-28(27)29/h11-14,19,21-25,30-33,37-39,49,59H,10,15-18,20H2,1-9H3,(H2,48,61)(H,50,65)(H,51,66)(H,52,60)(H,53,67)(H,54,70)(H,55,68)(H,56,62)(H,57,71)(H,58,69)(H,63,64)(H,72,73)/t23-,24+,25-,30+,31+,32+,33+,37+,38+,39+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 1.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Notre-Dame Hospital Research
Curated by ChEMBL
| Assay Description
Inhibitory concentration against HSV-1 ribonucleotide reductase R1 protein binding |
J Med Chem 35: 346-50 (1992)
BindingDB Entry DOI: 10.7270/Q2348JB2 |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Homo sapiens (Human)) | BDBM50000153
(CHEMBL386066 | Ribonucleotide reductase inhibiting...)Show SMILES CC[C@@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)[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/C45H70N10O17/c1-9-22(6)36(43(69)50-28(16-32(46)60)40(66)49-29(17-34(62)63)41(67)51-30(45(71)72)14-20(2)3)55-42(68)35(21(4)5)54-44(70)37(23(7)57)53-33(61)18-47-38(64)31(19-56)52-39(65)27(48-24(8)58)15-25-10-12-26(59)13-11-25/h10-13,20-23,27-31,35-37,56-57,59H,9,14-19H2,1-8H3,(H2,46,60)(H,47,64)(H,48,58)(H,49,66)(H,50,69)(H,51,67)(H,52,65)(H,53,61)(H,54,70)(H,55,68)(H,62,63)(H,71,72)/t22-,23-,27+,28+,29+,30+,31+,35+,36+,37+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 2.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Notre-Dame Hospital Research
Curated by ChEMBL
| Assay Description
Inhibitory concentaration against HSV-1 ribonucleotide reductase R1 protein binding |
J Med Chem 35: 346-50 (1992)
BindingDB Entry DOI: 10.7270/Q2348JB2 |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Homo sapiens (Human)) | BDBM50000152
(CHEMBL277280 | Ribonucleotide reductase inhibiting...)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](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)[C@@H](C)CC)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/C46H72N10O16/c1-10-22(5)36(43(68)52-30(18-33(47)60)41(66)51-31(19-35(62)63)42(67)53-32(46(71)72)16-21(3)4)55-44(69)37(23(6)11-2)56-45(70)38(25(8)57)54-34(61)20-48-39(64)24(7)49-40(65)29(50-26(9)58)17-27-12-14-28(59)15-13-27/h12-15,21-25,29-32,36-38,57,59H,10-11,16-20H2,1-9H3,(H2,47,60)(H,48,64)(H,49,65)(H,50,58)(H,51,66)(H,52,68)(H,53,67)(H,54,61)(H,55,69)(H,56,70)(H,62,63)(H,71,72)/t22-,23+,24+,25-,29+,30+,31+,32+,36+,37+,38+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 2.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Notre-Dame Hospital Research
Curated by ChEMBL
| Assay Description
Inhibitory concentaration against HSV-1 ribonucleotide reductase R1 protein binding |
J Med Chem 35: 346-50 (1992)
BindingDB Entry DOI: 10.7270/Q2348JB2 |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Homo sapiens (Human)) | BDBM50000146
(CHEMBL414299 | Ribonucleotide reductase inhibiting...)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](Cc1ccc(O)c(I)c1)NC(C)=O)[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/C45H69IN10O16/c1-10-21(6)36(43(69)52-28(16-32(47)60)40(66)51-29(17-34(62)63)41(67)53-30(45(71)72)13-19(2)3)56-42(68)35(20(4)5)55-44(70)37(23(8)57)54-33(61)18-48-38(64)22(7)49-39(65)27(50-24(9)58)15-25-11-12-31(59)26(46)14-25/h11-12,14,19-23,27-30,35-37,57,59H,10,13,15-18H2,1-9H3,(H2,47,60)(H,48,64)(H,49,65)(H,50,58)(H,51,66)(H,52,69)(H,53,67)(H,54,61)(H,55,70)(H,56,68)(H,62,63)(H,71,72)/t21-,22+,23-,27+,28+,29+,30+,35+,36+,37+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 2.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Notre-Dame Hospital Research
Curated by ChEMBL
| Assay Description
Inhibitory concentration against HSV-1 ribonucleotide reductase R1 protein binding |
J Med Chem 35: 346-50 (1992)
BindingDB Entry DOI: 10.7270/Q2348JB2 |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Homo sapiens (Human)) | BDBM50000165
(CHEMBL437817 | Ribonucleotide reductase inhibiting...)Show SMILES CC[C@@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)[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/C45H70N10O16S/c1-9-22(6)36(43(68)50-28(16-32(46)59)40(65)49-29(17-34(61)62)41(66)51-30(45(70)71)14-20(2)3)55-42(67)35(21(4)5)54-44(69)37(23(7)56)53-33(60)18-47-38(63)31(19-72)52-39(64)27(48-24(8)57)15-25-10-12-26(58)13-11-25/h10-13,20-23,27-31,35-37,56,58,72H,9,14-19H2,1-8H3,(H2,46,59)(H,47,63)(H,48,57)(H,49,65)(H,50,68)(H,51,66)(H,52,64)(H,53,60)(H,54,69)(H,55,67)(H,61,62)(H,70,71)/t22-,23-,27+,28+,29+,30+,31+,35+,36+,37+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 3.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Notre-Dame Hospital Research
Curated by ChEMBL
| Assay Description
Inhibitory concentaration against HSV-1 ribonucleotide reductase R1 protein binding |
J Med Chem 35: 346-50 (1992)
BindingDB Entry DOI: 10.7270/Q2348JB2 |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Homo sapiens (Human)) | BDBM50000154
(2-{2-[2-(2-{2-[2-(2-{2-[2-Acetylamino-3-(4-hydroxy...)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](Cc1ccc(O)cc1)NC(C)=O)[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/C45H70N10O16/c1-10-22(6)36(43(68)51-29(17-32(46)59)40(65)50-30(18-34(61)62)41(66)52-31(45(70)71)15-20(2)3)55-42(67)35(21(4)5)54-44(69)37(24(8)56)53-33(60)19-47-38(63)23(7)48-39(64)28(49-25(9)57)16-26-11-13-27(58)14-12-26/h11-14,20-24,28-31,35-37,56,58H,10,15-19H2,1-9H3,(H2,46,59)(H,47,63)(H,48,64)(H,49,57)(H,50,65)(H,51,68)(H,52,66)(H,53,60)(H,54,69)(H,55,67)(H,61,62)(H,70,71)/t22-,23+,24-,28+,29+,30+,31+,35+,36+,37+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 3.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Notre-Dame Hospital Research
Curated by ChEMBL
| Assay Description
Inhibitory concentaration against HSV-1 ribonucleotide reductase R1 protein binding |
J Med Chem 35: 346-50 (1992)
BindingDB Entry DOI: 10.7270/Q2348JB2 |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Homo sapiens (Human)) | BDBM50000149
(CHEMBL261954 | Ribonucleotide reductase inhibiting...)Show SMILES CC[C@@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)[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/C46H72N10O17/c1-10-22(6)36(44(70)51-29(17-32(47)61)39(65)50-30(18-34(63)64)40(66)52-31(46(72)73)15-20(2)3)55-43(69)35(21(4)5)54-45(71)38(24(8)58)53-33(62)19-48-42(68)37(23(7)57)56-41(67)28(49-25(9)59)16-26-11-13-27(60)14-12-26/h11-14,20-24,28-31,35-38,57-58,60H,10,15-19H2,1-9H3,(H2,47,61)(H,48,68)(H,49,59)(H,50,65)(H,51,70)(H,52,66)(H,53,62)(H,54,71)(H,55,69)(H,56,67)(H,63,64)(H,72,73)/t22-,23-,24-,28+,29+,30+,31+,35+,36+,37+,38+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 3.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Notre-Dame Hospital Research
Curated by ChEMBL
| Assay Description
Inhibitory concentaration against HSV-1 ribonucleotide reductase R1 protein binding |
J Med Chem 35: 346-50 (1992)
BindingDB Entry DOI: 10.7270/Q2348JB2 |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Homo sapiens (Human)) | BDBM50000166
(2-{2-[2-(2-{2-[2-(2-{2-[2-Acetylamino-3-(4-hydroxy...)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](Cc1ccc(O)cc1)NC(C)=O)C(C)C)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/C46H72N10O15/c1-11-24(8)38(45(69)52-30(18-33(47)59)41(65)51-31(19-35(61)62)42(66)53-32(46(70)71)16-21(2)3)56-44(68)37(23(6)7)55-43(67)36(22(4)5)54-34(60)20-48-39(63)25(9)49-40(64)29(50-26(10)57)17-27-12-14-28(58)15-13-27/h12-15,21-25,29-32,36-38,58H,11,16-20H2,1-10H3,(H2,47,59)(H,48,63)(H,49,64)(H,50,57)(H,51,65)(H,52,69)(H,53,66)(H,54,60)(H,55,67)(H,56,68)(H,61,62)(H,70,71)/t24-,25+,29+,30+,31+,32+,36+,37+,38+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 3.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Notre-Dame Hospital Research
Curated by ChEMBL
| Assay Description
Inhibitory concentaration against HSV-1 ribonucleotide reductase R1 protein binding |
J Med Chem 35: 346-50 (1992)
BindingDB Entry DOI: 10.7270/Q2348JB2 |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Homo sapiens (Human)) | BDBM50000163
(CHEMBL386716 | Ribonucleotide reductase inhibiting...)Show SMILES CC[C@@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(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/C44H68N10O15S/c1-9-22(6)36(43(67)51-28(16-32(45)57)39(63)50-29(17-34(59)60)40(64)52-30(44(68)69)14-20(2)3)54-42(66)35(21(4)5)53-41(65)31(19-70)49-33(58)18-46-37(61)23(7)47-38(62)27(48-24(8)55)15-25-10-12-26(56)13-11-25/h10-13,20-23,27-31,35-36,56,70H,9,14-19H2,1-8H3,(H2,45,57)(H,46,61)(H,47,62)(H,48,55)(H,49,58)(H,50,63)(H,51,67)(H,52,64)(H,53,65)(H,54,66)(H,59,60)(H,68,69)/t22-,23+,27+,28+,29+,30+,31+,35+,36+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 3.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Notre-Dame Hospital Research
Curated by ChEMBL
| Assay Description
Inhibitory concentaration against HSV-1 ribonucleotide reductase R1 protein binding |
J Med Chem 35: 346-50 (1992)
BindingDB Entry DOI: 10.7270/Q2348JB2 |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Homo sapiens (Human)) | BDBM50000164
(CHEMBL405583 | Ribonucleotide reductase inhibiting...)Show SMILES CC[C@@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(C)C)[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/C47H74N10O16/c1-11-24(8)38(45(70)52-30(18-33(48)61)40(65)51-31(19-35(63)64)41(66)53-32(47(72)73)16-21(2)3)57-44(69)37(23(6)7)56-46(71)39(25(9)58)54-34(62)20-49-43(68)36(22(4)5)55-42(67)29(50-26(10)59)17-27-12-14-28(60)15-13-27/h12-15,21-25,29-32,36-39,58,60H,11,16-20H2,1-10H3,(H2,48,61)(H,49,68)(H,50,59)(H,51,65)(H,52,70)(H,53,66)(H,54,62)(H,55,67)(H,56,71)(H,57,69)(H,63,64)(H,72,73)/t24-,25-,29+,30+,31+,32+,36+,37+,38+,39+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 4.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Notre-Dame Hospital Research
Curated by ChEMBL
| Assay Description
Inhibitory concentaration against HSV-1 ribonucleotide reductase R1 protein binding |
J Med Chem 35: 346-50 (1992)
BindingDB Entry DOI: 10.7270/Q2348JB2 |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Homo sapiens (Human)) | BDBM50000157
(CHEMBL261962 | Ribonucleotide reductase inhibiting...)Show SMILES CC[C@@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)[C@H](C)CC)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/C46H72N10O17/c1-9-22(5)36(43(69)51-29(17-33(47)61)41(67)50-30(18-35(63)64)42(68)52-31(46(72)73)15-21(3)4)55-44(70)37(23(6)10-2)56-45(71)38(24(7)58)54-34(62)19-48-39(65)32(20-57)53-40(66)28(49-25(8)59)16-26-11-13-27(60)14-12-26/h11-14,21-24,28-32,36-38,57-58,60H,9-10,15-20H2,1-8H3,(H2,47,61)(H,48,65)(H,49,59)(H,50,67)(H,51,69)(H,52,68)(H,53,66)(H,54,62)(H,55,70)(H,56,71)(H,63,64)(H,72,73)/t22-,23-,24-,28+,29+,30+,31+,32+,36+,37+,38+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 4.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Notre-Dame Hospital Research
Curated by ChEMBL
| Assay Description
Inhibitory concentration against HSV-1 ribonucleotide reductase R1 protein binding |
J Med Chem 35: 346-50 (1992)
BindingDB Entry DOI: 10.7270/Q2348JB2 |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Homo sapiens (Human)) | BDBM50000137
(CHEMBL263845 | Ribonucleotide reductase inhibiting...)Show SMILES CC[C@@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)C(C)C)[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/C48H76N10O16/c1-12-24(8)38(46(71)53-31(19-34(49)62)42(67)52-32(20-35(63)64)43(68)54-33(48(73)74)17-21(2)3)57-44(69)37(23(6)7)56-47(72)39(26(10)59)58-45(70)36(22(4)5)55-40(65)25(9)50-41(66)30(51-27(11)60)18-28-13-15-29(61)16-14-28/h13-16,21-26,30-33,36-39,59,61H,12,17-20H2,1-11H3,(H2,49,62)(H,50,66)(H,51,60)(H,52,67)(H,53,71)(H,54,68)(H,55,65)(H,56,72)(H,57,69)(H,58,70)(H,63,64)(H,73,74)/t24-,25+,26-,30+,31+,32+,33+,36+,37+,38+,39+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 4.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Notre-Dame Hospital Research
Curated by ChEMBL
| Assay Description
Inhibitory concentaration against HSV-1 ribonucleotide reductase R1 protein binding |
J Med Chem 35: 346-50 (1992)
BindingDB Entry DOI: 10.7270/Q2348JB2 |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Homo sapiens (Human)) | BDBM50000145
(CHEMBL386344 | Ribonucleotide reductase inhibiting...)Show SMILES CC[C@@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(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/C44H68N10O16/c1-9-22(6)36(43(68)51-28(16-32(45)58)39(64)50-29(17-34(60)61)40(65)52-30(44(69)70)14-20(2)3)54-42(67)35(21(4)5)53-41(66)31(19-55)49-33(59)18-46-37(62)23(7)47-38(63)27(48-24(8)56)15-25-10-12-26(57)13-11-25/h10-13,20-23,27-31,35-36,55,57H,9,14-19H2,1-8H3,(H2,45,58)(H,46,62)(H,47,63)(H,48,56)(H,49,59)(H,50,64)(H,51,68)(H,52,65)(H,53,66)(H,54,67)(H,60,61)(H,69,70)/t22-,23+,27+,28+,29+,30+,31+,35+,36+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 5.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Notre-Dame Hospital Research
Curated by ChEMBL
| Assay Description
Inhibitory concentaration against HSV-1 ribonucleotide reductase R1 protein binding |
J Med Chem 35: 346-50 (1992)
BindingDB Entry DOI: 10.7270/Q2348JB2 |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Homo sapiens (Human)) | BDBM50000148
(2-{2-[2-(2-{2-[2-(2-{2-[2-Acetylamino-3-(4-fluoro-...)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](Cc1ccc(F)cc1)NC(C)=O)[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/C45H69FN10O15/c1-10-22(6)36(43(68)52-29(17-32(47)59)40(65)51-30(18-34(61)62)41(66)53-31(45(70)71)15-20(2)3)56-42(67)35(21(4)5)55-44(69)37(24(8)57)54-33(60)19-48-38(63)23(7)49-39(64)28(50-25(9)58)16-26-11-13-27(46)14-12-26/h11-14,20-24,28-31,35-37,57H,10,15-19H2,1-9H3,(H2,47,59)(H,48,63)(H,49,64)(H,50,58)(H,51,65)(H,52,68)(H,53,66)(H,54,60)(H,55,69)(H,56,67)(H,61,62)(H,70,71)/t22-,23+,24-,28+,29+,30+,31+,35+,36+,37+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 5.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Notre-Dame Hospital Research
Curated by ChEMBL
| Assay Description
Inhibitory concentaration against HSV-1 ribonucleotide reductase R1 protein binding |
J Med Chem 35: 346-50 (1992)
BindingDB Entry DOI: 10.7270/Q2348JB2 |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Homo sapiens (Human)) | BDBM50000134
(2-{2-[2-(2-{2-[2-(2-{2-[2-Acetylamino-3-(4-chloro-...)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](Cc1ccc(Cl)cc1)NC(C)=O)[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/C45H69ClN10O15/c1-10-22(6)36(43(68)52-29(17-32(47)59)40(65)51-30(18-34(61)62)41(66)53-31(45(70)71)15-20(2)3)56-42(67)35(21(4)5)55-44(69)37(24(8)57)54-33(60)19-48-38(63)23(7)49-39(64)28(50-25(9)58)16-26-11-13-27(46)14-12-26/h11-14,20-24,28-31,35-37,57H,10,15-19H2,1-9H3,(H2,47,59)(H,48,63)(H,49,64)(H,50,58)(H,51,65)(H,52,68)(H,53,66)(H,54,60)(H,55,69)(H,56,67)(H,61,62)(H,70,71)/t22-,23+,24-,28+,29+,30+,31+,35+,36+,37+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 5.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Notre-Dame Hospital Research
Curated by ChEMBL
| Assay Description
Inhibitory concentration against HSV-1 ribonucleotide reductase R1 protein binding |
J Med Chem 35: 346-50 (1992)
BindingDB Entry DOI: 10.7270/Q2348JB2 |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Homo sapiens (Human)) | BDBM50000159
(CHEMBL331824 | Ribonucleotide reductase inhibiting...)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](Cc1cc(I)c(O)c(I)c1)NC(C)=O)[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/C45H68I2N10O16/c1-10-20(6)35(43(70)53-28(15-31(48)60)40(67)52-29(16-33(62)63)41(68)54-30(45(72)73)11-18(2)3)57-42(69)34(19(4)5)56-44(71)36(22(8)58)55-32(61)17-49-38(65)21(7)50-39(66)27(51-23(9)59)14-24-12-25(46)37(64)26(47)13-24/h12-13,18-22,27-30,34-36,58,64H,10-11,14-17H2,1-9H3,(H2,48,60)(H,49,65)(H,50,66)(H,51,59)(H,52,67)(H,53,70)(H,54,68)(H,55,61)(H,56,71)(H,57,69)(H,62,63)(H,72,73)/t20-,21+,22-,27+,28+,29+,30+,34+,35+,36+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 8.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Notre-Dame Hospital Research
Curated by ChEMBL
| Assay Description
Inhibitory concentration against HSV-1 ribonucleotide reductase R1 protein binding |
J Med Chem 35: 346-50 (1992)
BindingDB Entry DOI: 10.7270/Q2348JB2 |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Homo sapiens (Human)) | BDBM50000151
(2-{2-[2-(2-{2-[2-(2-{2-[2-Acetylamino-3-(4-hydroxy...)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](Cc1ccc(O)cc1)NC(C)=O)[C@@H](C)O)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/C45H69N9O17/c1-10-22(6)36(43(68)50-30(18-34(61)62)40(65)49-29(17-33(59)60)41(66)51-31(45(70)71)15-20(2)3)54-42(67)35(21(4)5)53-44(69)37(24(8)55)52-32(58)19-46-38(63)23(7)47-39(64)28(48-25(9)56)16-26-11-13-27(57)14-12-26/h11-14,20-24,28-31,35-37,55,57H,10,15-19H2,1-9H3,(H,46,63)(H,47,64)(H,48,56)(H,49,65)(H,50,68)(H,51,66)(H,52,58)(H,53,69)(H,54,67)(H,59,60)(H,61,62)(H,70,71)/t22-,23+,24-,28+,29+,30+,31+,35+,36+,37+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 8.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Notre-Dame Hospital Research
Curated by ChEMBL
| Assay Description
Inhibitory concentaration against HSV-1 ribonucleotide reductase R1 protein binding |
J Med Chem 35: 346-50 (1992)
BindingDB Entry DOI: 10.7270/Q2348JB2 |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Homo sapiens (Human)) | BDBM50000161
(2-[2-(2-{2-[2-(2-{2-[2-(2-Acetylamino-3-cyclohexyl...)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](CC1CCCCC1)NC(C)=O)[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/C45H76N10O15/c1-10-23(6)36(43(67)51-29(18-32(46)58)40(64)50-30(19-34(60)61)41(65)52-31(45(69)70)16-21(2)3)55-42(66)35(22(4)5)54-44(68)37(25(8)56)53-33(59)20-47-38(62)24(7)48-39(63)28(49-26(9)57)17-27-14-12-11-13-15-27/h21-25,27-31,35-37,56H,10-20H2,1-9H3,(H2,46,58)(H,47,62)(H,48,63)(H,49,57)(H,50,64)(H,51,67)(H,52,65)(H,53,59)(H,54,68)(H,55,66)(H,60,61)(H,69,70)/t23-,24+,25-,28+,29+,30+,31+,35+,36+,37+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 1.13E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Notre-Dame Hospital Research
Curated by ChEMBL
| Assay Description
Inhibitory concentaration against HSV-1 ribonucleotide reductase R1 protein binding |
J Med Chem 35: 346-50 (1992)
BindingDB Entry DOI: 10.7270/Q2348JB2 |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...) | BDBM50013347
(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 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 1.20E+4 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2XD128X |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Homo sapiens (Human)) | BDBM50000138
(CHEMBL384014 | Ribonucleotide reductase inhibiting...)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](Cc1ccc(O)cc1)N(C)C(C)=O)[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/C46H72N10O16/c1-11-23(6)37(44(69)51-29(18-33(47)60)40(65)50-30(19-35(62)63)41(66)52-31(46(71)72)16-21(2)3)55-43(68)36(22(4)5)54-45(70)38(25(8)57)53-34(61)20-48-39(64)24(7)49-42(67)32(56(10)26(9)58)17-27-12-14-28(59)15-13-27/h12-15,21-25,29-32,36-38,57,59H,11,16-20H2,1-10H3,(H2,47,60)(H,48,64)(H,49,67)(H,50,65)(H,51,69)(H,52,66)(H,53,61)(H,54,70)(H,55,68)(H,62,63)(H,71,72)/t23-,24+,25-,29+,30+,31+,32+,36+,37+,38+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 1.21E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Notre-Dame Hospital Research
Curated by ChEMBL
| Assay Description
Inhibitory concentration against HSV-1 ribonucleotide reductase R1 protein binding |
J Med Chem 35: 346-50 (1992)
BindingDB Entry DOI: 10.7270/Q2348JB2 |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...) | BDBM50013377
(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 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 1.30E+4 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2XD128X |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Homo sapiens (Human)) | BDBM50000162
(CHEMBL263439 | Ribonucleotide reductase inhibiting...)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](Cc1cn(C=O)c2ccccc12)NC(C)=O)[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/C48H71N11O16/c1-10-24(6)39(46(72)54-31(17-35(49)63)43(69)53-32(18-37(65)66)44(70)55-33(48(74)75)15-22(2)3)58-45(71)38(23(4)5)57-47(73)40(26(8)61)56-36(64)19-50-41(67)25(7)51-42(68)30(52-27(9)62)16-28-20-59(21-60)34-14-12-11-13-29(28)34/h11-14,20-26,30-33,38-40,61H,10,15-19H2,1-9H3,(H2,49,63)(H,50,67)(H,51,68)(H,52,62)(H,53,69)(H,54,72)(H,55,70)(H,56,64)(H,57,73)(H,58,71)(H,65,66)(H,74,75)/t24-,25+,26-,30+,31+,32+,33+,38+,39+,40+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 1.38E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Notre-Dame Hospital Research
Curated by ChEMBL
| Assay Description
Inhibitory concentration against HSV-1 ribonucleotide reductase R1 protein binding |
J Med Chem 35: 346-50 (1992)
BindingDB Entry DOI: 10.7270/Q2348JB2 |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Homo sapiens (Human)) | BDBM50000155
(CHEMBL265013 | Ribonucleotide reductase inhibiting...)Show SMILES CC[C@@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(C)=O)[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/C46H72N10O16/c1-11-22(6)36(44(69)52-30(18-33(47)60)41(66)51-31(19-34(61)62)42(67)53-32(46(71)72)16-20(2)3)55-43(68)35(21(4)5)54-45(70)37(25(9)57)56-39(64)24(8)48-38(63)23(7)49-40(65)29(50-26(10)58)17-27-12-14-28(59)15-13-27/h12-15,20-25,29-32,35-37,57,59H,11,16-19H2,1-10H3,(H2,47,60)(H,48,63)(H,49,65)(H,50,58)(H,51,66)(H,52,69)(H,53,67)(H,54,70)(H,55,68)(H,56,64)(H,61,62)(H,71,72)/t22-,23+,24+,25-,29+,30+,31+,32+,35+,36+,37+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 1.43E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Notre-Dame Hospital Research
Curated by ChEMBL
| Assay Description
Inhibitory concentaration against HSV-1 ribonucleotide reductase R1 protein binding |
J Med Chem 35: 346-50 (1992)
BindingDB Entry DOI: 10.7270/Q2348JB2 |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...) | BDBM50366468
(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 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 1.50E+4 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2XD128X |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...) | BDBM50013353
(CHEMBL2371374 | Thr-Asp-Phe-Phe-Glu-Cys-Arg-Ser-Th...)Show SMILES [#6]-[#6](-[#6])-[#6]-[#6](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#16])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccccc1)-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccccc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6](-[#6])-[#8])-[#6@@H](-[#6])-[#8])-[#6](-[#6])-[#6])-[#6](-[#6])-[#6])-[#6](-[#8])=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 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 1.50E+4 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2XD128X |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...) | BDBM50013371
(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 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2XD128X |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...) | BDBM50013357
(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 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 2.90E+4 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2XD128X |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...) | BDBM50013370
(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 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 2.90E+4 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2XD128X |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Homo sapiens (Human)) | BDBM50000139
(2-[2-(2-{2-[2-(2-{2-[2-(2-Acetylamino-4-phenyl-but...)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](CCc1ccccc1)NC(C)=O)[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/C46H72N10O15/c1-10-24(6)37(44(68)52-30(19-33(47)59)41(65)51-31(20-35(61)62)42(66)53-32(46(70)71)18-22(2)3)56-43(67)36(23(4)5)55-45(69)38(26(8)57)54-34(60)21-48-39(63)25(7)49-40(64)29(50-27(9)58)17-16-28-14-12-11-13-15-28/h11-15,22-26,29-32,36-38,57H,10,16-21H2,1-9H3,(H2,47,59)(H,48,63)(H,49,64)(H,50,58)(H,51,65)(H,52,68)(H,53,66)(H,54,60)(H,55,69)(H,56,67)(H,61,62)(H,70,71)/t24-,25+,26-,29+,30+,31+,32+,36+,37+,38+/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Notre-Dame Hospital Research
Curated by ChEMBL
| Assay Description
Inhibitory concentration against HSV-1 ribonucleotide reductase R1 protein binding |
J Med Chem 35: 346-50 (1992)
BindingDB Entry DOI: 10.7270/Q2348JB2 |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...) | BDBM50013384
(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 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 3.30E+4 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2XD128X |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...) | BDBM50013345
(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 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 3.30E+4 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2XD128X |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...) | BDBM50013381
(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 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 3.60E+4 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2XD128X |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...) | BDBM50013366
((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 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 3.60E+4 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2XD128X |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...) | BDBM50013358
(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 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 3.60E+4 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2XD128X |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...) | BDBM50013372
(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 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 3.60E+4 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2XD128X |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...) | BDBM50013354
(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 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 3.60E+4 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2XD128X |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...) | BDBM50013376
(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 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 3.70E+4 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2XD128X |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...) | BDBM50013362
(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 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2XD128X |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...) | BDBM50013377
(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 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 4.20E+4 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2XD128X |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...) | BDBM50013364
(CHEMBL2371380 | Glu-Cys-Arg-Ser-Thr-Ser-Tyr-Ala-Gl...)Show SMILES [#6]-[#6](-[#6])-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#8])=O)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#7])=O)-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@H](-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccc(-[#8])cc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#8])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#16])-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6](-[#8])=O)-[#6@@H](-[#6])-[#8])-[#6](-[#6])-[#6])-[#6](-[#6])-[#6])-[#6](-[#8])=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 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 4.20E+4 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2XD128X |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...) | BDBM50013383
(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 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 4.40E+4 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2XD128X |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...) | BDBM50013376
(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 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 4.40E+4 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2XD128X |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...) | BDBM50013347
(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 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 4.40E+4 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2XD128X |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...) | BDBM50013363
(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 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 4.40E+4 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2XD128X |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...) | BDBM50013370
(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 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 4.40E+4 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2XD128X |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...) | BDBM50013363
(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 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 4.80E+4 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2XD128X |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...) | BDBM50013384
(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 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 4.90E+4 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2XD128X |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...) | BDBM50013356
(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 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2XD128X |
More data for this
Ligand-Target Pair | |
Ribonucleoside-diphosphate reductase large subunit
(Human herpesvirus 1 (strain 17) (HHV-1) (Human her...) | BDBM50013378
(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 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 5.50E+4 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2XD128X |
More data for this
Ligand-Target Pair | |
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