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Compile Data Set for Download or QSAR

Found 12 hits with Last Name = 'silberstein' and Initial = 'c'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Reverse transcriptase


(Human immunodeficiency virus 1)
BDBM50478430
PNG
(CHEMBL500695)
Show SMILES [Na;v0+].[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6](=O)-[#8]-[#6@@H](-[#6]-[#8]-[#6@H]-1-[#8]-[#6@H](-[#6]S([#8-])(=O)=O)-[#6@@H](-[#8])-[#6@H](-[#8])-[#6@H]-1-[#8])-[#6]-[#8]-[#6](=O)-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]\[#6]=[#6]/[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6] |r|
Show InChI InChI=1S/C43H80O12S.Na/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-38(44)52-33-36(34-53-43-42(48)41(47)40(46)37(55-43)35-56(49,50)51)54-39(45)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2;/h17-18,36-37,40-43,46-48H,3-16,19-35H2,1-2H3,(H,49,50,51);/q;+1/p-1/b18-17-;/t36-,37-,40-,41+,42-,43+;/m1./s1
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UniProtKB/TrEMBL

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n/an/a 24n/an/an/an/an/an/a



Tel-Aviv University

Curated by ChEMBL


Assay Description
Inhibition of HIV1 reverse transcriptase activity assessed as residual enzyme activity by poly(rA)n.oligo(dT)12-18-directed incorporation of [3H]dTTP...


J Nat Prod 61: 891-5 (1998)


Article DOI: 10.1021/np970585j
BindingDB Entry DOI: 10.7270/Q2RX9FVR
More data for this
Ligand-Target Pair
Reverse transcriptase


(Human immunodeficiency virus 1)
BDBM50478436
PNG
(CHEMBL448380)
Show SMILES [Na;v0+].[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6](=O)-[#8]-[#6@@H](-[#6]-[#8]-[#6@H]-1-[#8]-[#6@H](-[#6]S([#8-])(=O)=O)-[#6@@H](-[#8])-[#6@H](-[#8])-[#6@H]-1-[#8])-[#6]-[#8]-[#6](=O)-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]\[#6]=[#6]/[#6]\[#6]=[#6]/[#6]-[#6]-[#6]-[#6]-[#6] |r|
Show InChI InChI=1S/C43H78O12S.Na/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-38(44)52-33-36(34-53-43-42(48)41(47)40(46)37(55-43)35-56(49,50)51)54-39(45)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2;/h11,13,17-18,36-37,40-43,46-48H,3-10,12,14-16,19-35H2,1-2H3,(H,49,50,51);/q;+1/p-1/b13-11-,18-17-;/t36-,37-,40-,41+,42-,43+;/m1./s1
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n/an/a 77n/an/an/an/an/an/a



Tel-Aviv University

Curated by ChEMBL


Assay Description
Inhibition of HIV1 reverse transcriptase activity assessed as residual enzyme activity by poly(rA)n.oligo(dT)12-18-directed incorporation of [3H]dTTP...


J Nat Prod 61: 891-5 (1998)


Article DOI: 10.1021/np970585j
BindingDB Entry DOI: 10.7270/Q2RX9FVR
More data for this
Ligand-Target Pair
Reverse transcriptase


(Human immunodeficiency virus 1)
BDBM50478431
PNG
(CHEMBL455390)
Show SMILES [Na;v0+].[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6](=O)-[#8]-[#6]-[#6@H](-[#6]-[#8]-[#6@H]-1-[#8]-[#6@H](-[#6]S([#8-])(=O)=O)-[#6@@H](-[#8])-[#6@H](-[#8])-[#6@H]-1-[#8])-[#8]-[#6](=O)-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6] |r|
Show InChI InChI=1S/C41H78O12S.Na/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-36(42)50-31-34(32-51-41-40(46)39(45)38(44)35(53-41)33-54(47,48)49)52-37(43)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;/h34-35,38-41,44-46H,3-33H2,1-2H3,(H,47,48,49);/q;+1/p-1/t34-,35-,38-,39+,40-,41+;/m1./s1
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n/an/a 112n/an/an/an/an/an/a



Tel-Aviv University

Curated by ChEMBL


Assay Description
Inhibition of HIV1 reverse transcriptase activity assessed as residual enzyme activity by poly(rA)n.oligo(dT)12-18-directed incorporation of [3H]dTTP...


J Nat Prod 61: 891-5 (1998)


Article DOI: 10.1021/np970585j
BindingDB Entry DOI: 10.7270/Q2RX9FVR
More data for this
Ligand-Target Pair
Reverse transcriptase


(Human immunodeficiency virus 1)
BDBM50478437
PNG
(CHEMBL506716)
Show SMILES [Na;v0+].[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6](=O)-[#8]-[#6@@H](-[#6]-[#8]-[#6@H]-1-[#8]-[#6@H](-[#6]S([#8-])(=O)=O)-[#6@@H](-[#8])-[#6@H](-[#8]-[#6](=O)-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6])-[#6@H]-1-[#8]-[#6](=O)-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6])-[#6]-[#8]-[#6](=O)-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]\[#6]=[#6]/[#6]\[#6]=[#6]/[#6]-[#6]-[#6]-[#6]-[#6] |r|
Show InChI InChI=1S/C75H138O14S.Na/c1-5-9-13-17-21-25-29-33-34-38-39-43-47-51-55-59-68(76)84-63-66(86-69(77)60-56-52-48-44-40-35-30-26-22-18-14-10-6-2)64-85-75-74(89-71(79)62-58-54-50-46-42-37-32-28-24-20-16-12-8-4)73(72(80)67(87-75)65-90(81,82)83)88-70(78)61-57-53-49-45-41-36-31-27-23-19-15-11-7-3;/h21,25,33-34,66-67,72-75,80H,5-20,22-24,26-32,35-65H2,1-4H3,(H,81,82,83);/q;+1/p-1/b25-21-,34-33-;/t66-,67-,72-,73+,74-,75+;/m1./s1
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n/an/a 2.95E+3n/an/an/an/an/an/a



Tel-Aviv University

Curated by ChEMBL


Assay Description
Inhibition of HIV1 reverse transcriptase activity assessed as residual enzyme activity by poly(rA)n.oligo(dT)12-18-directed incorporation of [3H]dTTP...


J Nat Prod 61: 891-5 (1998)


Article DOI: 10.1021/np970585j
BindingDB Entry DOI: 10.7270/Q2RX9FVR
More data for this
Ligand-Target Pair
Reverse transcriptase


(Human immunodeficiency virus 1)
BDBM50478432
PNG
(CHEMBL448268)
Show SMILES CCCCCCCCCCCCCCCC(=O)O[C@@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)COC(=O)CCCCCCC\C=C/C\C=C/CCCCC |r|
Show InChI InChI=1S/C43H78O10/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-38(45)50-34-36(35-51-43-42(49)41(48)40(47)37(33-44)53-43)52-39(46)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2/h11,13,17-18,36-37,40-44,47-49H,3-10,12,14-16,19-35H2,1-2H3/b13-11-,18-17-/t36-,37-,40+,41+,42-,43-/m1/s1
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n/an/a 3.80E+4n/an/an/an/an/an/a



Tel-Aviv University

Curated by ChEMBL


Assay Description
Inhibition of HIV1 reverse transcriptase activity assessed as residual enzyme activity by poly(rA)n.oligo(dT)12-18-directed incorporation of [3H]dTTP...


J Nat Prod 61: 891-5 (1998)


Article DOI: 10.1021/np970585j
BindingDB Entry DOI: 10.7270/Q2RX9FVR
More data for this
Ligand-Target Pair
Reverse transcriptase


(Human immunodeficiency virus 1)
BDBM50478438
PNG
(CHEBI:90507 | CHEMBL499250)
Show SMILES CCCCCCCCCCCCCCCC(=O)O[C@@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)COC(=O)CCCCCCC\C=C/CCCCCCCC |r|
Show InChI InChI=1S/C43H80O10/c1-3-5-7-9-11-13-15-17-18-20-21-23-25-27-29-31-38(45)50-34-36(35-51-43-42(49)41(48)40(47)37(33-44)53-43)52-39(46)32-30-28-26-24-22-19-16-14-12-10-8-6-4-2/h17-18,36-37,40-44,47-49H,3-16,19-35H2,1-2H3/b18-17-/t36-,37-,40+,41+,42-,43-/m1/s1
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UniProtKB/TrEMBL

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n/an/a 6.50E+4n/an/an/an/an/an/a



Tel-Aviv University

Curated by ChEMBL


Assay Description
Inhibition of HIV1 reverse transcriptase activity assessed as residual enzyme activity by poly(rA)n.oligo(dT)12-18-directed incorporation of [3H]dTTP...


J Nat Prod 61: 891-5 (1998)


Article DOI: 10.1021/np970585j
BindingDB Entry DOI: 10.7270/Q2RX9FVR
More data for this
Ligand-Target Pair
Reverse transcriptase


(Human immunodeficiency virus 1)
BDBM50478434
PNG
(CHEMBL470759)
Show SMILES [Na;v0+].[#8]-[#6]-[#6@@H](-[#8])-[#6]-[#8]-[#6@H]-1-[#8]-[#6@H](-[#6]S([#8-])(=O)=O)-[#6@@H](-[#8])-[#6@H](-[#8])-[#6@H]-1-[#8] |r|
Show InChI InChI=1S/C9H18O10S.Na/c10-1-4(11)2-18-9-8(14)7(13)6(12)5(19-9)3-20(15,16)17;/h4-14H,1-3H2,(H,15,16,17);/q;+1/p-1/t4-,5-,6-,7+,8-,9+;/m1./s1
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n/an/a 7.50E+4n/an/an/an/an/an/a



Tel-Aviv University

Curated by ChEMBL


Assay Description
Inhibition of HIV1 reverse transcriptase activity assessed as residual enzyme activity by poly(rA)n.oligo(dT)12-18-directed incorporation of [3H]dTTP...


J Nat Prod 61: 891-5 (1998)


Article DOI: 10.1021/np970585j
BindingDB Entry DOI: 10.7270/Q2RX9FVR
More data for this
Ligand-Target Pair
Reverse transcriptase


(Human immunodeficiency virus 1)
BDBM50478433
PNG
(CHEMBL447743)
Show SMILES CCCCCCCCCCCCCCCC(=O)O[C@@H](CO[C@@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@H](O)[C@H](OC(=O)CCCCCCCCCCCCCCC)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O)COC(=O)CCCCCCC\C=C/C\C=C/CCCCC |r|
Show InChI InChI=1S/C65H118O16/c1-4-7-10-13-16-19-22-25-26-29-30-33-36-39-42-45-55(67)75-49-52(78-56(68)46-43-40-37-34-31-27-23-20-17-14-11-8-5-2)50-76-64-61(73)60(72)58(70)54(80-64)51-77-65-62(74)63(59(71)53(48-66)79-65)81-57(69)47-44-41-38-35-32-28-24-21-18-15-12-9-6-3/h16,19,25-26,52-54,58-66,70-74H,4-15,17-18,20-24,27-51H2,1-3H3/b19-16-,26-25-/t52-,53-,54-,58+,59+,60+,61-,62-,63+,64-,65+/m1/s1
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n/an/a 9.94E+4n/an/an/an/an/an/a



Tel-Aviv University

Curated by ChEMBL


Assay Description
Inhibition of HIV1 reverse transcriptase activity assessed as residual enzyme activity by poly(rA)n.oligo(dT)12-18-directed incorporation of [3H]dTTP...


J Nat Prod 61: 891-5 (1998)


Article DOI: 10.1021/np970585j
BindingDB Entry DOI: 10.7270/Q2RX9FVR
More data for this
Ligand-Target Pair
Reverse transcriptase


(Human immunodeficiency virus 1)
BDBM50478440
PNG
(CHEMBL472021)
Show SMILES OC[C@@H](O)CO[C@@H]1O[C@H](CO[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H](O)[C@H]1O |r|
Show InChI InChI=1S/C15H28O13/c16-1-5(18)3-25-14-13(24)11(22)9(20)7(28-14)4-26-15-12(23)10(21)8(19)6(2-17)27-15/h5-24H,1-4H2/t5-,6-,7-,8+,9+,10+,11+,12-,13-,14-,15+/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



Tel-Aviv University

Curated by ChEMBL


Assay Description
Inhibition of HIV1 reverse transcriptase activity assessed as residual enzyme activity by poly(rA)n.oligo(dT)12-18-directed incorporation of [3H]dTTP...


J Nat Prod 61: 891-5 (1998)


Article DOI: 10.1021/np970585j
BindingDB Entry DOI: 10.7270/Q2RX9FVR
More data for this
Ligand-Target Pair
Reverse transcriptase


(Human immunodeficiency virus 1)
BDBM50478439
PNG
(CHEBI:63774 | CHEMBL443117)
Show SMILES CCCCCCCCCCCCCCCC(=O)OC[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCCCCCCCCCC |r|
Show InChI InChI=1S/C41H78O10/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-36(43)48-32-34(33-49-41-40(47)39(46)38(45)35(31-42)51-41)50-37(44)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h34-35,38-42,45-47H,3-33H2,1-2H3/t34-,35-,38+,39+,40-,41-/m1/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



Tel-Aviv University

Curated by ChEMBL


Assay Description
Inhibition of HIV1 reverse transcriptase activity assessed as residual enzyme activity by poly(rA)n.oligo(dT)12-18-directed incorporation of [3H]dTTP...


J Nat Prod 61: 891-5 (1998)


Article DOI: 10.1021/np970585j
BindingDB Entry DOI: 10.7270/Q2RX9FVR
More data for this
Ligand-Target Pair
Reverse transcriptase


(Human immunodeficiency virus 1)
BDBM50478441
PNG
(CHEBI:15754 | CHEMBL446492)
Show SMILES OC[C@@H](O)CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O |r|
Show InChI InChI=1S/C9H18O8/c10-1-4(12)3-16-9-8(15)7(14)6(13)5(2-11)17-9/h4-15H,1-3H2/t4-,5-,6+,7+,8-,9-/m1/s1
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Tel-Aviv University

Curated by ChEMBL


Assay Description
Inhibition of HIV1 reverse transcriptase activity assessed as residual enzyme activity by poly(rA)n.oligo(dT)12-18-directed incorporation of [3H]dTTP...


J Nat Prod 61: 891-5 (1998)


Article DOI: 10.1021/np970585j
BindingDB Entry DOI: 10.7270/Q2RX9FVR
More data for this
Ligand-Target Pair
Reverse transcriptase


(Human immunodeficiency virus 1)
BDBM50478435
PNG
(CHEMBL450754)
Show SMILES OC[C@@H](O)CO[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |r|
Show InChI InChI=1S/C9H18O8/c10-1-4(12)3-16-9-8(15)7(14)6(13)5(2-11)17-9/h4-15H,1-3H2/t4-,5-,6-,7+,8-,9+/m1/s1
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Tel-Aviv University

Curated by ChEMBL


Assay Description
Inhibition of HIV1 reverse transcriptase activity assessed as residual enzyme activity by poly(rA)n.oligo(dT)12-18-directed incorporation of [3H]dTTP...


J Nat Prod 61: 891-5 (1998)


Article DOI: 10.1021/np970585j
BindingDB Entry DOI: 10.7270/Q2RX9FVR
More data for this
Ligand-Target Pair