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Compile Data Set for Download or QSAR

Found 22 hits Enz. Inhib. hit(s) with Target = 'Ribonucleoside-diphosphate reductase M1 chain' AND taxid = 10090   
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 M1 chain


(Mus musculus)
BDBM50368749
PNG
(CHEMBL1790913)
Show SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(C)=O)[C@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C41H55N7O14/c1-21(2)16-27(46-40(60)34(23(4)49)48-39(59)28(43-24(5)50)17-25-12-8-6-9-13-25)37(57)45-29(19-32(51)52)36(56)42-22(3)35(55)44-30(20-33(53)54)38(58)47-31(41(61)62)18-26-14-10-7-11-15-26/h6-15,21-23,27-31,34,49H,16-20H2,1-5H3,(H,42,56)(H,43,50)(H,44,55)(H,45,57)(H,46,60)(H,47,58)(H,48,59)(H,51,52)(H,53,54)(H,61,62)/t22-,23-,27-,28-,29-,30-,31-,34-/m0/s1
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n/an/a 8.00E+3n/an/an/an/an/an/a



University of Pennsylvania

Curated by ChEMBL


Assay Description
Inhibitory activity of compound against mammalian ribonucleotide reductase; Range is 8-20


J Med Chem 36: 3859-62 (1994)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase M1 chain


(Mus musculus)
BDBM50368768
PNG
(CHEMBL1790908)
Show SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(C)=O)[C@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C44H60N8O16/c1-22(2)16-28(50-43(66)36(24(4)54)52-41(64)29(17-26-12-8-6-9-13-26)48-42(65)33(21-53)46-25(5)55)39(62)49-30(19-34(56)57)38(61)45-23(3)37(60)47-31(20-35(58)59)40(63)51-32(44(67)68)18-27-14-10-7-11-15-27/h6-15,22-24,28-33,36,53-54H,16-21H2,1-5H3,(H,45,61)(H,46,55)(H,47,60)(H,48,65)(H,49,62)(H,50,66)(H,51,63)(H,52,64)(H,56,57)(H,58,59)(H,67,68)/t23-,24-,28-,29-,30-,31-,32-,33-,36-/m0/s1
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n/an/a 8.00E+3n/an/an/an/an/an/a



University of Pennsylvania

Curated by ChEMBL


Assay Description
Inhibitory activity of compound against mammalian ribonucleotide reductase; Range is 8-20


J Med Chem 36: 3859-62 (1994)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase M1 chain


(Mus musculus)
BDBM50368751
PNG
(CHEMBL1790907)
Show SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(C)=O)[C@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C48H66N10O18/c1-23(2)16-29(42(69)54-32(20-37(63)64)41(68)50-24(3)40(67)52-33(21-38(65)66)44(71)56-34(48(75)76)18-28-14-10-7-11-15-28)55-47(74)39(25(4)60)58-45(72)30(17-27-12-8-6-9-13-27)53-46(73)35(22-59)57-43(70)31(19-36(49)62)51-26(5)61/h6-15,23-25,29-35,39,59-60H,16-22H2,1-5H3,(H2,49,62)(H,50,68)(H,51,61)(H,52,67)(H,53,73)(H,54,69)(H,55,74)(H,56,71)(H,57,70)(H,58,72)(H,63,64)(H,65,66)(H,75,76)/t24-,25-,29-,30-,31-,32-,33-,34-,35-,39-/m0/s1
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n/an/a 9.00E+3n/an/an/an/an/an/a



University of Pennsylvania

Curated by ChEMBL


Assay Description
Inhibitory activity of compound against mammalian ribonucleotide reductase; Range is 9-15


J Med Chem 36: 3859-62 (1994)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase M1 chain


(Mus musculus)
BDBM50368745
PNG
(CHEMBL2369633)
Show SMILES C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(C)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C46H56N8O15/c1-25(55)39(54-44(66)31(48-26(2)56)20-27-12-6-3-7-13-27)45(67)52-32(21-28-14-8-4-9-15-28)41(63)50-33(23-36(47)57)42(64)49-30(18-19-37(58)59)40(62)51-34(24-38(60)61)43(65)53-35(46(68)69)22-29-16-10-5-11-17-29/h3-17,25,30-35,39,55H,18-24H2,1-2H3,(H2,47,57)(H,48,56)(H,49,64)(H,50,63)(H,51,62)(H,52,67)(H,53,65)(H,54,66)(H,58,59)(H,60,61)(H,68,69)/t25-,30+,31+,32+,33+,34+,35+,39+/m1/s1
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n/an/a 2.50E+4n/an/an/an/an/an/a



University of Pennsylvania

Curated by ChEMBL


Assay Description
Cross inhibitory potency of compound on Saccharomyces cerevisiae R2 C-terminal peptide on Saccharomyces cerevisiae ribonucleotide reductase


J Med Chem 36: 3859-62 (1994)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase M1 chain


(Mus musculus)
BDBM50368749
PNG
(CHEMBL1790913)
Show SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(C)=O)[C@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C41H55N7O14/c1-21(2)16-27(46-40(60)34(23(4)49)48-39(59)28(43-24(5)50)17-25-12-8-6-9-13-25)37(57)45-29(19-32(51)52)36(56)42-22(3)35(55)44-30(20-33(53)54)38(58)47-31(41(61)62)18-26-14-10-7-11-15-26/h6-15,21-23,27-31,34,49H,16-20H2,1-5H3,(H,42,56)(H,43,50)(H,44,55)(H,45,57)(H,46,60)(H,47,58)(H,48,59)(H,51,52)(H,53,54)(H,61,62)/t22-,23-,27-,28-,29-,30-,31-,34-/m0/s1
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n/an/a 2.50E+4n/an/an/an/an/an/a



University of Pennsylvania

Curated by ChEMBL


Assay Description
Cross inhibitory potency of compound on Saccharomyces cerevisiae R2 C-terminal peptide on Saccharomyces cerevisiae ribonucleotide reductase


J Med Chem 36: 3859-62 (1994)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase M1 chain


(Mus musculus)
BDBM50368764
PNG
(CHEMBL2369635)
Show SMILES C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](C)NC(C)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C54H69N11O18/c1-28(57-31(4)67)46(74)56-27-42(69)58-29(2)47(75)60-37(23-33-16-10-6-11-17-33)52(80)65-45(30(3)66)53(81)63-36(22-32-14-8-5-9-15-32)49(77)61-38(25-41(55)68)50(78)59-35(20-21-43(70)71)48(76)62-39(26-44(72)73)51(79)64-40(54(82)83)24-34-18-12-7-13-19-34/h5-19,28-30,35-40,45,66H,20-27H2,1-4H3,(H2,55,68)(H,56,74)(H,57,67)(H,58,69)(H,59,78)(H,60,75)(H,61,77)(H,62,76)(H,63,81)(H,64,79)(H,65,80)(H,70,71)(H,72,73)(H,82,83)/t28-,29-,30+,35-,36-,37-,38-,39-,40-,45-/m0/s1
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n/an/a 2.50E+4n/an/an/an/an/an/a



University of Pennsylvania

Curated by ChEMBL


Assay Description
Cross inhibitory potency of compound on Saccharomyces cerevisiae R2 C-terminal peptide on Saccharomyces cerevisiae ribonucleotide reductase


J Med Chem 36: 3859-62 (1994)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase M1 chain


(Mus musculus)
BDBM50368754
PNG
(CHEMBL1790927)
Show SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(C)=O)[C@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C41H56N8O13/c1-21(2)16-27(47-40(60)34(23(4)50)49-39(59)28(44-24(5)51)17-25-12-8-6-9-13-25)37(57)46-29(19-32(42)52)36(56)43-22(3)35(55)45-30(20-33(53)54)38(58)48-31(41(61)62)18-26-14-10-7-11-15-26/h6-15,21-23,27-31,34,50H,16-20H2,1-5H3,(H2,42,52)(H,43,56)(H,44,51)(H,45,55)(H,46,57)(H,47,60)(H,48,58)(H,49,59)(H,53,54)(H,61,62)/t22-,23-,27-,28-,29-,30-,31-,34-/m0/s1
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n/an/a 2.50E+4n/an/an/an/an/an/a



University of Pennsylvania

Curated by ChEMBL


Assay Description
Inhibitory activity of compound against mammalian ribonucleotide reductase; Range is 25-29


J Med Chem 36: 3859-62 (1994)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase M1 chain


(Mus musculus)
BDBM50368770
PNG
(CHEMBL1790906)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(C)=O)[C@H](C)O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C43H61N7O12/c1-23(2)18-30(40(58)49-34(43(61)62)21-29-16-12-9-13-17-29)46-37(55)25(5)44-38(56)33(22-35(53)54)47-39(57)31(19-24(3)4)48-42(60)36(26(6)51)50-41(59)32(45-27(7)52)20-28-14-10-8-11-15-28/h8-17,23-26,30-34,36,51H,18-22H2,1-7H3,(H,44,56)(H,45,52)(H,46,55)(H,47,57)(H,48,60)(H,49,58)(H,50,59)(H,53,54)(H,61,62)/t25-,26-,30-,31-,32-,33-,34-,36-/m0/s1
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n/an/a 2.90E+4n/an/an/an/an/an/a



University of Pennsylvania

Curated by ChEMBL


Assay Description
Inhibitory activity of compound against mammalian ribonucleotide reductase; Range is 29-30


J Med Chem 36: 3859-62 (1994)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase M1 chain


(Mus musculus)
BDBM50368756
PNG
(CHEMBL1790917)
Show SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(C)=O)[C@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C41H56N8O13/c1-21(2)16-27(47-40(60)34(23(4)50)49-39(59)28(44-24(5)51)17-25-12-8-6-9-13-25)37(57)46-30(20-33(53)54)36(56)43-22(3)35(55)45-29(19-32(42)52)38(58)48-31(41(61)62)18-26-14-10-7-11-15-26/h6-15,21-23,27-31,34,50H,16-20H2,1-5H3,(H2,42,52)(H,43,56)(H,44,51)(H,45,55)(H,46,57)(H,47,60)(H,48,58)(H,49,59)(H,53,54)(H,61,62)/t22-,23-,27-,28-,29-,30-,31-,34-/m0/s1
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n/an/a 3.20E+4n/an/an/an/an/an/a



University of Pennsylvania

Curated by ChEMBL


Assay Description
Inhibitory activity of compound against mammalian ribonucleotide reductase; Range is 32-38


J Med Chem 36: 3859-62 (1994)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase M1 chain


(Mus musculus)
BDBM50368746
PNG
(CHEMBL1790905)
Show SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(C)=O)[C@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C40H55N7O12/c1-21(2)17-28(45-39(57)33(24(5)48)47-38(56)29(43-25(6)49)18-26-13-9-7-10-14-26)37(55)44-30(20-32(50)51)36(54)42-22(3)34(52)41-23(4)35(53)46-31(40(58)59)19-27-15-11-8-12-16-27/h7-16,21-24,28-31,33,48H,17-20H2,1-6H3,(H,41,52)(H,42,54)(H,43,49)(H,44,55)(H,45,57)(H,46,53)(H,47,56)(H,50,51)(H,58,59)/t22-,23-,24-,28-,29-,30-,31-,33-/m0/s1
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n/an/a 3.40E+4n/an/an/an/an/an/a



University of Pennsylvania

Curated by ChEMBL


Assay Description
Inhibitory activity of compound against mammalian ribonucleotide reductase; Range is 34-35


J Med Chem 36: 3859-62 (1994)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase M1 chain


(Mus musculus)
BDBM50042881
PNG
(3-{2-[2-(2-Acetylamino-3-phenyl-propionylamino)-pr...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(C)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C40H53N7O13/c1-21(2)16-27(44-34(53)22(3)41-36(55)28(43-24(5)48)17-25-12-8-6-9-13-25)38(57)46-29(19-32(49)50)37(56)42-23(4)35(54)45-30(20-33(51)52)39(58)47-31(40(59)60)18-26-14-10-7-11-15-26/h6-15,21-23,27-31H,16-20H2,1-5H3,(H,41,55)(H,42,56)(H,43,48)(H,44,53)(H,45,54)(H,46,57)(H,47,58)(H,49,50)(H,51,52)(H,59,60)/t22-,23-,27-,28-,29-,30-,31-/m0/s1
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n/an/a 3.50E+4n/an/an/an/an/an/a



University of Pennsylvania

Curated by ChEMBL


Assay Description
Inhibitory activity of compound against mammalian ribonucleotide reductase; Range is 35-40


J Med Chem 36: 3859-62 (1994)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase M1 chain


(Mus musculus)
BDBM50042895
PNG
(3-{2-[2-(2-Acetylamino-3-phenyl-propionylamino)-3-...)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(C)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C40H53N7O14/c1-21(2)15-26(44-39(59)31(20-48)47-37(57)27(42-23(4)49)16-24-11-7-5-8-12-24)36(56)45-28(18-32(50)51)35(55)41-22(3)34(54)43-29(19-33(52)53)38(58)46-30(40(60)61)17-25-13-9-6-10-14-25/h5-14,21-22,26-31,48H,15-20H2,1-4H3,(H,41,55)(H,42,49)(H,43,54)(H,44,59)(H,45,56)(H,46,58)(H,47,57)(H,50,51)(H,52,53)(H,60,61)/t22-,26-,27-,28-,29-,30-,31-/m0/s1
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n/an/a 4.00E+4n/an/an/an/an/an/a



University of Pennsylvania

Curated by ChEMBL


Assay Description
Inhibitory activity of compound against mammalian ribonucleotide reductase; Range is 40-42


J Med Chem 36: 3859-62 (1994)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase M1 chain/Ribonucleoside-diphosphate reductase M2 chain/Ribonucleotide reductase


(Homo sapiens)
BDBM50174197
PNG
((S)-3-(2-((3S,3aR,5S,7S,7aS)-7-((3-(9H-fluoren-9-y...)
Show SMILES CC(C)CO[C@@H]1C[C@H]2[C@H](O)CN(CC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc3ccccc3)C(O)=O)[C@@H]2[C@@H](COC(=O)CCC2c3ccccc3-c3ccccc23)O1
Show InChI InChI=1S/C43H51N3O11/c1-25(2)23-56-40-19-32-35(47)21-46(22-37(48)44-33(20-38(49)50)42(52)45-34(43(53)54)18-26-10-4-3-5-11-26)41(32)36(57-40)24-55-39(51)17-16-31-29-14-8-6-12-27(29)28-13-7-9-15-30(28)31/h3-15,25,31-36,40-41,47H,16-24H2,1-2H3,(H,44,48)(H,45,52)(H,49,50)(H,53,54)/t32-,33-,34-,35+,36+,40-,41-/m0/s1
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n/an/a 4.00E+4n/an/an/an/an/an/a



University of Pennsylvania

Curated by ChEMBL


Assay Description
Inhibition of mammalian ribonucleotide reductase (mRR)


Citation and Details
More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase M1 chain


(Mus musculus)
BDBM50368750
PNG
(CHEMBL1790903)
Show SMILES C[C@H](O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(C)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C44H53N7O14/c1-24(38(58)47-33(23-36(56)57)41(61)50-34(44(64)65)21-29-17-11-6-12-18-29)45-39(59)32(22-35(54)55)48-40(60)31(20-28-15-9-5-10-16-28)49-43(63)37(25(2)52)51-42(62)30(46-26(3)53)19-27-13-7-4-8-14-27/h4-18,24-25,30-34,37,52H,19-23H2,1-3H3,(H,45,59)(H,46,53)(H,47,58)(H,48,60)(H,49,63)(H,50,61)(H,51,62)(H,54,55)(H,56,57)(H,64,65)/t24-,25-,30-,31-,32-,33-,34-,37-/m0/s1
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PubMed
n/an/a 4.80E+4n/an/an/an/an/an/a



University of Pennsylvania

Curated by ChEMBL


Assay Description
Inhibitory activity of compound against mammalian ribonucleotide reductase; Range is 48-58


J Med Chem 36: 3859-62 (1994)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase M1 chain


(Mus musculus)
BDBM50368745
PNG
(CHEMBL2369633)
Show SMILES C[C@@H](O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(C)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C46H56N8O15/c1-25(55)39(54-44(66)31(48-26(2)56)20-27-12-6-3-7-13-27)45(67)52-32(21-28-14-8-4-9-15-28)41(63)50-33(23-36(47)57)42(64)49-30(18-19-37(58)59)40(62)51-34(24-38(60)61)43(65)53-35(46(68)69)22-29-16-10-5-11-17-29/h3-17,25,30-35,39,55H,18-24H2,1-2H3,(H2,47,57)(H,48,56)(H,49,64)(H,50,63)(H,51,62)(H,52,67)(H,53,65)(H,54,66)(H,58,59)(H,60,61)(H,68,69)/t25-,30+,31+,32+,33+,34+,35+,39+/m1/s1
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PubMed
n/an/a 1.00E+5n/an/an/an/an/an/a



University of Pennsylvania

Curated by ChEMBL


Assay Description
Cross inhibitory potency of compound on Saccharomyces cerevisiae R2 C-terminal peptide on mammalian ribonucleotide reductase


J Med Chem 36: 3859-62 (1994)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase M1 chain


(Mus musculus)
BDBM50368747
PNG
(CHEMBL1790911)
Show SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(C)=O)[C@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)NCC(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C40H53N7O14/c1-21(2)15-26(45-39(59)34(22(3)48)47-38(58)27(42-23(4)49)16-24-11-7-5-8-12-24)36(56)44-28(18-32(51)52)35(55)41-20-31(50)43-29(19-33(53)54)37(57)46-30(40(60)61)17-25-13-9-6-10-14-25/h5-14,21-22,26-30,34,48H,15-20H2,1-4H3,(H,41,55)(H,42,49)(H,43,50)(H,44,56)(H,45,59)(H,46,57)(H,47,58)(H,51,52)(H,53,54)(H,60,61)/t22-,26-,27-,28-,29-,30-,34-/m0/s1
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PubMed
n/an/a 1.10E+5n/an/an/an/an/an/a



University of Pennsylvania

Curated by ChEMBL


Assay Description
Inhibitory activity of compound against mammalian ribonucleotide reductase; Range is 110-230


J Med Chem 36: 3859-62 (1994)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase M1 chain/Ribonucleotide reductase


(Homo sapiens)
BDBM50214817
PNG
(CHEMBL236757 | N6-aminoadenosine)
Show SMILES NNc1ncnc2n(cnc12)[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
Show InChI InChI=1S/C10H14N6O4/c11-15-8-5-9(13-2-12-8)16(3-14-5)10-7(19)6(18)4(1-17)20-10/h2-4,6-7,10,17-19H,1,11H2,(H,12,13,15)/t4-,6-,7-,10-/m1/s1
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Article
PubMed
n/an/a 2.44E+5n/an/an/an/an/an/a



University of Camerino

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ribonucleotide reductase p53R2/M1 expressed in Escherichia coli BL21 (DE3) after 30 mins by [3H]CDP reduction method


Citation and Details
More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase M1 chain


(Mus musculus)
BDBM50368753
PNG
(CHEMBL1790916)
Show SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(C)=O)[C@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C40H55N7O12/c1-21(2)17-28(45-39(57)33(24(5)48)47-38(56)29(43-25(6)49)18-26-13-9-7-10-14-26)36(54)42-22(3)34(52)41-23(4)35(53)44-30(20-32(50)51)37(55)46-31(40(58)59)19-27-15-11-8-12-16-27/h7-16,21-24,28-31,33,48H,17-20H2,1-6H3,(H,41,52)(H,42,54)(H,43,49)(H,44,53)(H,45,57)(H,46,55)(H,47,56)(H,50,51)(H,58,59)/t22-,23-,24-,28-,29-,30-,31-,33-/m0/s1
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PubMed
n/an/a 2.86E+5n/an/an/an/an/an/a



University of Pennsylvania

Curated by ChEMBL


Assay Description
Inhibitory activity of compound against mammalian ribonucleotide reductase; Range is 286-336


J Med Chem 36: 3859-62 (1994)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase M1 chain


(Mus musculus)
BDBM50368763
PNG
(CHEMBL1790921)
Show SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(C)=O)[C@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C34H45N5O10/c1-19(2)15-24(30(44)36-26(18-28(42)43)31(45)38-27(34(48)49)17-23-13-9-6-10-14-23)37-33(47)29(20(3)40)39-32(46)25(35-21(4)41)16-22-11-7-5-8-12-22/h5-14,19-20,24-27,29,40H,15-18H2,1-4H3,(H,35,41)(H,36,44)(H,37,47)(H,38,45)(H,39,46)(H,42,43)(H,48,49)/t20-,24-,25-,26-,27-,29-/m0/s1
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PubMed
n/an/a 3.64E+5n/an/an/an/an/an/a



University of Pennsylvania

Curated by ChEMBL


Assay Description
Inhibitory activity of compound against mammalian ribonucleotide reductase; Range is 364-460


J Med Chem 36: 3859-62 (1994)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase M1 chain


(Mus musculus)
BDBM50368755
PNG
(CHEMBL1790912)
Show SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(C)=O)[C@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C42H57N7O14/c1-22(2)18-29(47-41(61)35(24(4)50)49-40(60)30(44-25(5)51)19-26-12-8-6-9-13-26)39(59)46-31(21-34(54)55)38(58)43-23(3)36(56)45-28(16-17-33(52)53)37(57)48-32(42(62)63)20-27-14-10-7-11-15-27/h6-15,22-24,28-32,35,50H,16-21H2,1-5H3,(H,43,58)(H,44,51)(H,45,56)(H,46,59)(H,47,61)(H,48,57)(H,49,60)(H,52,53)(H,54,55)(H,62,63)/t23-,24-,28-,29-,30-,31-,32-,35-/m0/s1
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PubMed
n/an/a 4.50E+5n/an/an/an/an/an/a



University of Pennsylvania

Curated by ChEMBL


Assay Description
Inhibitory activity of compound against mammalian ribonucleotide reductase; Range is 450-620


J Med Chem 36: 3859-62 (1994)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase M1 chain


(Mus musculus)
BDBM50368762
PNG
(CHEMBL2369634)
Show SMILES C[C@@H](O)[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C37H47N7O14/c1-19(45)31(39-20(2)46)36(56)43-24(15-21-9-5-3-6-10-21)33(53)41-25(17-28(38)47)34(54)40-23(13-14-29(48)49)32(52)42-26(18-30(50)51)35(55)44-27(37(57)58)16-22-11-7-4-8-12-22/h3-12,19,23-27,31,45H,13-18H2,1-2H3,(H2,38,47)(H,39,46)(H,40,54)(H,41,53)(H,42,52)(H,43,56)(H,44,55)(H,48,49)(H,50,51)(H,57,58)/t19-,23+,24+,25+,26+,27+,31+/m1/s1
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PubMed
n/an/a 6.00E+5n/an/an/an/an/an/a



University of Pennsylvania

Curated by ChEMBL


Assay Description
Cross inhibitory potency of compound on Saccharomyces cerevisiae R2 C-terminal peptide on mammalian ribonucleotide reductase


J Med Chem 36: 3859-62 (1994)

More data for this
Ligand-Target Pair
Ribonucleoside-diphosphate reductase M1 chain


(Mus musculus)
BDBM50368762
PNG
(CHEMBL2369634)
Show SMILES C[C@@H](O)[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C37H47N7O14/c1-19(45)31(39-20(2)46)36(56)43-24(15-21-9-5-3-6-10-21)33(53)41-25(17-28(38)47)34(54)40-23(13-14-29(48)49)32(52)42-26(18-30(50)51)35(55)44-27(37(57)58)16-22-11-7-4-8-12-22/h3-12,19,23-27,31,45H,13-18H2,1-2H3,(H2,38,47)(H,39,46)(H,40,54)(H,41,53)(H,42,52)(H,43,56)(H,44,55)(H,48,49)(H,50,51)(H,57,58)/t19-,23+,24+,25+,26+,27+,31+/m1/s1
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PubMed
n/an/a 6.00E+5n/an/an/an/an/an/a



University of Pennsylvania

Curated by ChEMBL


Assay Description
Cross inhibitory potency of compound on Saccharomyces cerevisiae R2 C-terminal peptide on Saccharomyces cerevisiae ribonucleotide reductase


J Med Chem 36: 3859-62 (1994)

More data for this
Ligand-Target Pair