Found 166 hits with Last Name = 'feldkamp' and Initial = 'md' 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 |
|---|
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006654
(CHEMBL3236278)Show SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(C)=O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(N)=O |r| Show InChI InChI=1S/C69H104N16O31/c1-28(2)20-39(61(108)72-31(6)58(105)83-46(27-86)55(70)102)82-69(116)54(34(9)88)85-67(114)45(26-52(100)101)78-56(103)30(5)71-59(106)37(16-18-47(90)91)75-60(107)38(17-19-48(92)93)76-62(109)40(21-29(3)4)79-65(112)44(25-51(98)99)81-64(111)43(24-50(96)97)77-57(104)32(7)73-68(115)53(33(8)87)84-66(113)41(22-36-14-12-11-13-15-36)80-63(110)42(23-49(94)95)74-35(10)89/h11-15,28-34,37-46,53-54,86-88H,16-27H2,1-10H3,(H2,70,102)(H,71,106)(H,72,108)(H,73,115)(H,74,89)(H,75,107)(H,76,109)(H,77,104)(H,78,103)(H,79,112)(H,80,110)(H,81,111)(H,82,116)(H,83,105)(H,84,113)(H,85,114)(H,90,91)(H,92,93)(H,94,95)(H,96,97)(H,98,99)(H,100,101)/t30-,31-,32-,33+,34+,37-,38-,39-,40-,41-,42-,43-,44-,45-,46-,53-,54-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.97E+5 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006655
(CHEMBL3236277)Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(N)=O |r| Show InChI InChI=1S/C71H110N16O29/c1-30(2)22-42(63(108)74-35(9)60(105)86-56(37(11)90)71(116)84-43(23-31(3)4)64(109)73-33(7)59(104)85-49(29-88)57(72)102)80-62(107)41(19-21-51(94)95)77-61(106)40(18-20-50(92)93)78-65(110)44(24-32(5)6)81-68(113)48(28-54(100)101)83-67(112)47(27-53(98)99)79-58(103)34(8)75-70(115)55(36(10)89)87-69(114)45(25-39-16-14-13-15-17-39)82-66(111)46(26-52(96)97)76-38(12)91/h13-17,30-37,40-49,55-56,88-90H,18-29H2,1-12H3,(H2,72,102)(H,73,109)(H,74,108)(H,75,115)(H,76,91)(H,77,106)(H,78,110)(H,79,103)(H,80,107)(H,81,113)(H,82,111)(H,83,112)(H,84,116)(H,85,104)(H,86,105)(H,87,114)(H,92,93)(H,94,95)(H,96,97)(H,98,99)(H,100,101)/t33-,34-,35-,36+,37+,40-,41-,42-,43-,44-,45-,46-,47-,48-,49-,55-,56-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 8.50E+4 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006656
(CHEMBL3236276)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](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(N)=O |r| Show InChI InChI=1S/C71H108N16O30/c1-30(2)21-41(63(109)73-34(8)60(106)86-49(29-88)57(72)103)79-58(104)33(7)74-64(110)46(26-53(97)98)84-66(112)43(23-32(5)6)81-62(108)40(18-20-51(93)94)77-61(107)39(17-19-50(91)92)78-65(111)42(22-31(3)4)82-69(115)48(28-55(101)102)85-68(114)47(27-54(99)100)80-59(105)35(9)75-71(117)56(36(10)89)87-70(116)44(24-38-15-13-12-14-16-38)83-67(113)45(25-52(95)96)76-37(11)90/h12-16,30-36,39-49,56,88-89H,17-29H2,1-11H3,(H2,72,103)(H,73,109)(H,74,110)(H,75,117)(H,76,90)(H,77,107)(H,78,111)(H,79,104)(H,80,105)(H,81,108)(H,82,115)(H,83,113)(H,84,112)(H,85,114)(H,86,106)(H,87,116)(H,91,92)(H,93,94)(H,95,96)(H,97,98)(H,99,100)(H,101,102)/t33-,34-,35-,36+,39-,40-,41-,42-,43-,44-,45-,46-,47-,48-,49-,56-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.70E+4 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006657
(CHEMBL3236275)Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(N)=O |r| Show InChI InChI=1S/C69H104N16O31/c1-28(2)20-39(79-65(112)44(25-51(98)99)81-64(111)43(24-50(96)97)77-57(104)32(7)73-69(116)53(33(8)87)84-66(113)41(22-36-14-12-11-13-15-36)80-63(110)42(23-49(94)95)74-35(10)89)61(108)76-37(16-18-47(90)91)59(106)75-38(17-19-48(92)93)60(107)78-40(21-29(3)4)62(109)82-45(26-52(100)101)67(114)85-54(34(9)88)68(115)72-30(5)56(103)71-31(6)58(105)83-46(27-86)55(70)102/h11-15,28-34,37-46,53-54,86-88H,16-27H2,1-10H3,(H2,70,102)(H,71,103)(H,72,115)(H,73,116)(H,74,89)(H,75,106)(H,76,108)(H,77,104)(H,78,107)(H,79,112)(H,80,110)(H,81,111)(H,82,109)(H,83,105)(H,84,113)(H,85,114)(H,90,91)(H,92,93)(H,94,95)(H,96,97)(H,98,99)(H,100,101)/t30-,31-,32-,33+,34+,37-,38-,39-,40-,41-,42-,43-,44-,45-,46-,53-,54-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 6.30E+4 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006658
(CHEMBL3235924)Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(N)=O |r| Show InChI InChI=1S/C72H110N16O30/c1-30(2)22-42(63(109)75-34(8)59(105)74-33(7)58(73)104)86-72(118)57(37(11)90)88-70(116)49(29-55(102)103)85-65(111)44(24-32(5)6)81-62(108)41(19-21-51(94)95)78-61(107)40(18-20-50(92)93)79-64(110)43(23-31(3)4)82-68(114)48(28-54(100)101)84-67(113)47(27-53(98)99)80-60(106)35(9)76-71(117)56(36(10)89)87-69(115)45(25-39-16-14-13-15-17-39)83-66(112)46(26-52(96)97)77-38(12)91/h13-17,30-37,40-49,56-57,89-90H,18-29H2,1-12H3,(H2,73,104)(H,74,105)(H,75,109)(H,76,117)(H,77,91)(H,78,107)(H,79,110)(H,80,106)(H,81,108)(H,82,114)(H,83,112)(H,84,113)(H,85,111)(H,86,118)(H,87,115)(H,88,116)(H,92,93)(H,94,95)(H,96,97)(H,98,99)(H,100,101)(H,102,103)/t33-,34-,35-,36+,37+,40-,41-,42-,43-,44-,45-,46-,47-,48-,49-,56-,57-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 2.60E+4 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006659
(CHEMBL3235923)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](CCC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(N)=O |r| Show InChI InChI=1S/C69H106N16O28/c1-29(2)20-40(61(105)72-34(9)59(103)84-48(28-86)55(70)99)77-57(101)33(8)73-63(107)45(25-51(93)94)82-64(108)42(22-31(5)6)79-60(104)39(18-19-49(89)90)76-56(100)32(7)71-62(106)41(21-30(3)4)80-67(111)47(27-53(97)98)83-66(110)46(26-52(95)96)78-58(102)35(10)74-69(113)54(36(11)87)85-68(112)43(23-38-16-14-13-15-17-38)81-65(109)44(24-50(91)92)75-37(12)88/h13-17,29-36,39-48,54,86-87H,18-28H2,1-12H3,(H2,70,99)(H,71,106)(H,72,105)(H,73,107)(H,74,113)(H,75,88)(H,76,100)(H,77,101)(H,78,102)(H,79,104)(H,80,111)(H,81,109)(H,82,108)(H,83,110)(H,84,103)(H,85,112)(H,89,90)(H,91,92)(H,93,94)(H,95,96)(H,97,98)/t32-,33-,34-,35-,36+,39-,40-,41-,42-,43-,44-,45-,46-,47-,48-,54-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 2.00E+4 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006660
(CHEMBL3235922)Show SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(C)=O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(N)=O |r| Show InChI InChI=1S/C77H114N16O29/c1-35(2)26-47(68(113)79-38(7)65(110)91-55(34-94)63(78)108)90-77(122)62(41(10)96)93-75(120)50(29-43-18-14-12-15-19-43)87-70(115)49(28-37(5)6)85-67(112)46(23-25-57(100)101)82-66(111)45(22-24-56(98)99)83-69(114)48(27-36(3)4)86-73(118)54(33-60(106)107)89-72(117)53(32-59(104)105)84-64(109)39(8)80-76(121)61(40(9)95)92-74(119)51(30-44-20-16-13-17-21-44)88-71(116)52(31-58(102)103)81-42(11)97/h12-21,35-41,45-55,61-62,94-96H,22-34H2,1-11H3,(H2,78,108)(H,79,113)(H,80,121)(H,81,97)(H,82,111)(H,83,114)(H,84,109)(H,85,112)(H,86,118)(H,87,115)(H,88,116)(H,89,117)(H,90,122)(H,91,110)(H,92,119)(H,93,120)(H,98,99)(H,100,101)(H,102,103)(H,104,105)(H,106,107)/t38-,39-,40+,41+,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,55-,61-,62-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | 2.20E+4 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006661
(CHEMBL3235921)Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(N)=O |r| Show InChI InChI=1S/C77H109N17O31/c1-33(2)23-46(68(116)80-35(5)65(113)92-54(32-95)63(78)111)91-77(125)62(38(8)97)94-75(123)53(30-60(109)110)90-70(118)49(26-41-31-79-43-18-14-13-17-42(41)43)88-67(115)45(20-22-56(101)102)83-66(114)44(19-21-55(99)100)84-69(117)47(24-34(3)4)86-73(121)52(29-59(107)108)89-72(120)51(28-58(105)106)85-64(112)36(6)81-76(124)61(37(7)96)93-74(122)48(25-40-15-11-10-12-16-40)87-71(119)50(27-57(103)104)82-39(9)98/h10-18,31,33-38,44-54,61-62,79,95-97H,19-30,32H2,1-9H3,(H2,78,111)(H,80,116)(H,81,124)(H,82,98)(H,83,114)(H,84,117)(H,85,112)(H,86,121)(H,87,119)(H,88,115)(H,89,120)(H,90,118)(H,91,125)(H,92,113)(H,93,122)(H,94,123)(H,99,100)(H,101,102)(H,103,104)(H,105,106)(H,107,108)(H,109,110)/t35-,36-,37+,38+,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,61-,62-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.38E+5 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006662
(CHEMBL3235920)Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(N)=O |r| Show InChI InChI=1S/C82H113N17O29/c1-38(2)28-52(73(119)85-40(5)70(116)97-60(37-100)68(83)114)96-82(128)67(43(8)102)99-80(126)54(30-45-18-12-10-13-19-45)92-75(121)56(32-47-36-84-49-23-17-16-22-48(47)49)94-72(118)51(25-27-62(106)107)88-71(117)50(24-26-61(104)105)89-74(120)53(29-39(3)4)91-78(124)59(35-65(112)113)95-77(123)58(34-64(110)111)90-69(115)41(6)86-81(127)66(42(7)101)98-79(125)55(31-46-20-14-11-15-21-46)93-76(122)57(33-63(108)109)87-44(9)103/h10-23,36,38-43,50-60,66-67,84,100-102H,24-35,37H2,1-9H3,(H2,83,114)(H,85,119)(H,86,127)(H,87,103)(H,88,117)(H,89,120)(H,90,115)(H,91,124)(H,92,121)(H,93,122)(H,94,118)(H,95,123)(H,96,128)(H,97,116)(H,98,125)(H,99,126)(H,104,105)(H,106,107)(H,108,109)(H,110,111)(H,112,113)/t40-,41-,42+,43+,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,66-,67-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 2.70E+3 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006663
(CHEMBL3235919)Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(N)=O |r| Show InChI InChI=1S/C80H111N17O27/c1-37(2)27-51(89-76(120)58(34-63(108)109)93-75(119)57(33-62(106)107)88-68(112)41(7)85-79(123)64(42(8)99)96-77(121)54(30-46-21-15-12-16-22-46)91-74(118)56(32-61(104)105)86-44(10)101)71(115)83-39(5)67(111)87-50(25-26-60(102)103)70(114)92-55(31-47-35-82-49-24-18-17-23-48(47)49)73(117)90-53(29-45-19-13-11-14-20-45)78(122)97-65(43(9)100)80(124)94-52(28-38(3)4)72(116)84-40(6)69(113)95-59(36-98)66(81)110/h11-24,35,37-43,50-59,64-65,82,98-100H,25-34,36H2,1-10H3,(H2,81,110)(H,83,115)(H,84,116)(H,85,123)(H,86,101)(H,87,111)(H,88,112)(H,89,120)(H,90,117)(H,91,118)(H,92,114)(H,93,119)(H,94,124)(H,95,113)(H,96,121)(H,97,122)(H,102,103)(H,104,105)(H,106,107)(H,108,109)/t39-,40-,41-,42+,43+,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,64-,65-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | 4.30E+4 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006664
(CHEMBL3235918)Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(N)=O |r| Show InChI InChI=1S/C81H111N17O28/c1-38(2)28-52(73(118)84-41(6)70(115)97-60(37-99)67(82)112)90-68(113)40(5)85-74(119)54(30-45-18-12-10-13-19-45)93-76(121)56(32-47-36-83-49-23-17-16-22-48(47)49)95-72(117)51(25-27-62(104)105)88-71(116)50(24-26-61(102)103)89-75(120)53(29-39(3)4)92-79(124)59(35-65(110)111)96-78(123)58(34-64(108)109)91-69(114)42(7)86-81(126)66(43(8)100)98-80(125)55(31-46-20-14-11-15-21-46)94-77(122)57(33-63(106)107)87-44(9)101/h10-23,36,38-43,50-60,66,83,99-100H,24-35,37H2,1-9H3,(H2,82,112)(H,84,118)(H,85,119)(H,86,126)(H,87,101)(H,88,116)(H,89,120)(H,90,113)(H,91,114)(H,92,124)(H,93,121)(H,94,122)(H,95,117)(H,96,123)(H,97,115)(H,98,125)(H,102,103)(H,104,105)(H,106,107)(H,108,109)(H,110,111)/t40-,41-,42-,43+,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,66-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.20E+3 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006665
(CHEMBL3236288)Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(=S)Nc1ccc(c(c1)C(O)=O)-c1c2ccc(O)cc2oc2cc(=O)ccc12)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(N)=O |r,wU:100.104,85.88,72.75,56.59,134.143,4.3,38.41,13.13,145.153,wD:64.67,80.83,140.148,89.92,8.8,47.50,24.25,(64.07,-11.82,;62.73,-11.04,;62.73,-9.51,;61.4,-11.82,;61.4,-13.36,;60.06,-14.12,;58.73,-13.36,;58.73,-11.82,;57.39,-14.12,;57.39,-15.67,;56.06,-13.36,;54.72,-14.12,;54.72,-15.66,;53.39,-13.35,;53.39,-11.82,;54.72,-11.04,;54.73,-9.5,;56.06,-8.74,;57.4,-9.5,;57.4,-11.04,;56.06,-11.82,;52.05,-14.12,;50.71,-13.35,;50.71,-11.81,;49.38,-14.11,;49.38,-15.66,;50.71,-16.43,;52.12,-15.8,;53.13,-16.95,;52.36,-18.29,;52.85,-19.75,;51.81,-20.91,;50.3,-20.58,;49.84,-19.12,;50.87,-17.97,;48.05,-13.35,;46.71,-14.11,;46.71,-15.65,;45.38,-13.34,;45.38,-11.81,;46.71,-11.03,;46.71,-9.49,;45.38,-8.73,;48.05,-8.72,;44.04,-14.11,;42.71,-13.34,;42.71,-11.8,;41.37,-14.1,;41.37,-15.65,;42.71,-16.42,;42.71,-17.97,;41.37,-18.73,;44.04,-18.73,;40.03,-13.34,;38.7,-14.1,;38.7,-15.64,;37.37,-13.33,;37.37,-11.8,;38.7,-11.02,;40.03,-11.8,;38.7,-9.48,;36.03,-14.1,;34.69,-13.33,;34.69,-11.79,;33.37,-14.09,;33.37,-15.64,;34.69,-16.41,;36.03,-15.64,;34.69,-17.96,;32.03,-13.33,;30.7,-14.09,;30.7,-15.63,;29.35,-13.33,;29.35,-11.79,;30.7,-11.01,;32.03,-11.79,;30.7,-9.47,;28.03,-14.09,;26.69,-13.32,;26.69,-11.78,;25.36,-14.08,;25.36,-15.63,;24.01,-13.32,;22.69,-14.08,;22.69,-15.62,;21.35,-13.32,;20.02,-14.08,;18.68,-13.31,;18.68,-11.77,;17.35,-14.07,;17.35,-15.62,;18.68,-16.4,;18.67,-17.94,;19.99,-18.71,;21.33,-17.95,;21.33,-16.41,;20,-15.62,;16.01,-13.31,;14.67,-14.07,;14.67,-15.62,;13.34,-13.31,;13.34,-11.77,;14.68,-10.99,;16.01,-11.77,;14.68,-9.45,;12.01,-14.07,;10.69,-13.29,;10.71,-11.76,;9.36,-14.04,;8.04,-13.26,;6.72,-14,;5.39,-13.21,;5.41,-11.67,;6.75,-10.93,;8.07,-11.72,;7.16,-9.45,;8.65,-9.06,;6.08,-8.36,;4.08,-10.88,;2.75,-11.63,;2.73,-13.16,;1.38,-13.9,;.07,-13.12,;-1.29,-13.86,;.09,-11.58,;1.44,-10.84,;1.45,-9.3,;2.8,-8.57,;2.82,-7.03,;4.17,-6.27,;4.18,-4.72,;5.48,-7.07,;5.45,-8.6,;4.11,-9.35,;21.35,-11.78,;20.02,-11,;22.69,-11,;62.73,-14.13,;62.73,-15.67,;64.07,-13.37,;65.4,-14.13,;65.4,-15.68,;66.74,-13.37,;66.74,-11.83,;68.07,-14.13,;69.41,-13.37,;69.41,-11.83,;70.74,-11.05,;70.74,-14.14,;72.07,-13.38,;70.74,-15.68,)| Show InChI InChI=1S/C100H120N18O32S/c1-46(2)33-66(90(139)103-49(6)87(136)116-74(45-119)84(101)133)109-85(134)48(5)104-91(140)68(35-52-17-11-9-12-18-52)112-93(142)70(37-54-44-102-63-22-16-15-21-58(54)63)114-89(138)65(30-32-78(125)126)107-88(137)64(29-31-77(123)124)108-92(141)67(34-47(3)4)111-95(144)72(42-80(129)130)115-94(143)71(41-79(127)128)110-86(135)50(7)105-98(147)83(51(8)120)118-97(146)69(36-53-19-13-10-14-20-53)113-96(145)73(43-81(131)132)117-100(151)106-55-23-26-59(62(38-55)99(148)149)82-60-27-24-56(121)39-75(60)150-76-40-57(122)25-28-61(76)82/h9-28,38-40,44,46-51,64-74,83,102,119-121H,29-37,41-43,45H2,1-8H3,(H2,101,133)(H,103,139)(H,104,140)(H,105,147)(H,107,137)(H,108,141)(H,109,134)(H,110,135)(H,111,144)(H,112,142)(H,113,145)(H,114,138)(H,115,143)(H,116,136)(H,118,146)(H,123,124)(H,125,126)(H,127,128)(H,129,130)(H,131,132)(H,148,149)(H2,106,117,151)/t48-,49-,50-,51+,64-,65-,66-,67-,68-,69-,70-,71-,72-,73-,74-,83-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 480 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006666
(CHEMBL3236289)Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(N)=O |r| Show InChI InChI=1S/C81H112N18O27/c1-38(2)28-52(73(118)85-41(6)70(115)98-60(37-100)67(83)112)91-68(113)40(5)86-74(119)54(30-45-18-12-10-13-19-45)94-76(121)56(32-47-36-84-49-23-17-16-22-48(47)49)96-72(117)51(25-27-63(106)107)89-71(116)50(24-26-62(104)105)90-75(120)53(29-39(3)4)93-79(124)59(35-65(110)111)97-78(123)58(34-64(108)109)92-69(114)42(7)87-81(126)66(43(8)101)99-80(125)55(31-46-20-14-11-15-21-46)95-77(122)57(33-61(82)103)88-44(9)102/h10-23,36,38-43,50-60,66,84,100-101H,24-35,37H2,1-9H3,(H2,82,103)(H2,83,112)(H,85,118)(H,86,119)(H,87,126)(H,88,102)(H,89,116)(H,90,120)(H,91,113)(H,92,114)(H,93,124)(H,94,121)(H,95,122)(H,96,117)(H,97,123)(H,98,115)(H,99,125)(H,104,105)(H,106,107)(H,108,109)(H,110,111)/t40-,41-,42-,43+,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,66-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | 5.80E+3 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006667
(CHEMBL3236290)Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(N)=O |r| Show InChI InChI=1S/C80H111N17O26/c1-38(2)29-53(73(116)84-43(8)70(113)96-60(37-98)66(81)109)90-69(112)42(7)85-74(117)55(31-46-19-13-11-14-20-46)93-76(119)57(33-48-36-82-50-24-18-17-23-49(48)50)95-72(115)52(26-28-62(103)104)88-71(114)51(25-27-61(101)102)89-75(118)54(30-39(3)4)92-78(121)59(35-64(107)108)91-68(111)41(6)83-67(110)40(5)86-80(123)65(44(9)99)97-79(122)56(32-47-21-15-12-16-22-47)94-77(120)58(34-63(105)106)87-45(10)100/h11-24,36,38-44,51-60,65,82,98-99H,25-35,37H2,1-10H3,(H2,81,109)(H,83,110)(H,84,116)(H,85,117)(H,86,123)(H,87,100)(H,88,114)(H,89,118)(H,90,112)(H,91,111)(H,92,121)(H,93,119)(H,94,120)(H,95,115)(H,96,113)(H,97,122)(H,101,102)(H,103,104)(H,105,106)(H,107,108)/t40-,41-,42-,43-,44+,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,65-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 2.30E+3 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006668
(CHEMBL3236291)Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(N)=O |r| Show InChI InChI=1S/C81H112N18O27/c1-38(2)28-52(73(118)85-41(6)70(115)98-60(37-100)67(83)112)91-68(113)40(5)86-74(119)54(30-45-18-12-10-13-19-45)94-76(121)56(32-47-36-84-49-23-17-16-22-48(47)49)96-72(117)51(25-27-63(106)107)89-71(116)50(24-26-62(104)105)90-75(120)53(29-39(3)4)93-79(124)59(35-65(110)111)97-77(122)57(33-61(82)103)92-69(114)42(7)87-81(126)66(43(8)101)99-80(125)55(31-46-20-14-11-15-21-46)95-78(123)58(34-64(108)109)88-44(9)102/h10-23,36,38-43,50-60,66,84,100-101H,24-35,37H2,1-9H3,(H2,82,103)(H2,83,112)(H,85,118)(H,86,119)(H,87,126)(H,88,102)(H,89,116)(H,90,120)(H,91,113)(H,92,114)(H,93,124)(H,94,121)(H,95,123)(H,96,117)(H,97,122)(H,98,115)(H,99,125)(H,104,105)(H,106,107)(H,108,109)(H,110,111)/t40-,41-,42-,43+,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,66-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.90E+4 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006669
(CHEMBL3236292)Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(N)=O |r| Show InChI InChI=1S/C80H111N17O26/c1-38(2)29-53(73(116)83-42(7)70(113)96-60(37-98)66(81)109)90-67(110)40(5)84-74(117)55(31-46-19-13-11-14-20-46)93-77(120)57(33-48-36-82-50-24-18-17-23-49(48)50)95-72(115)52(26-28-62(103)104)88-71(114)51(25-27-61(101)102)89-76(119)54(30-39(3)4)91-68(111)41(6)85-75(118)59(35-64(107)108)92-69(112)43(8)86-80(123)65(44(9)99)97-79(122)56(32-47-21-15-12-16-22-47)94-78(121)58(34-63(105)106)87-45(10)100/h11-24,36,38-44,51-60,65,82,98-99H,25-35,37H2,1-10H3,(H2,81,109)(H,83,116)(H,84,117)(H,85,118)(H,86,123)(H,87,100)(H,88,114)(H,89,119)(H,90,110)(H,91,111)(H,92,112)(H,93,120)(H,94,121)(H,95,115)(H,96,113)(H,97,122)(H,101,102)(H,103,104)(H,105,106)(H,107,108)/t40-,41-,42-,43-,44+,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,65-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | 2.80E+4 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006670
(CHEMBL3236293)Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(N)=O |r| Show InChI InChI=1S/C81H112N18O27/c1-38(2)28-52(73(118)85-41(6)70(115)98-60(37-100)67(83)112)91-68(113)40(5)86-74(119)54(30-45-18-12-10-13-19-45)94-76(121)56(32-47-36-84-49-23-17-16-22-48(47)49)96-72(117)51(25-27-63(106)107)89-71(116)50(24-26-62(104)105)90-75(120)53(29-39(3)4)93-77(122)57(33-61(82)103)97-79(124)59(35-65(110)111)92-69(114)42(7)87-81(126)66(43(8)101)99-80(125)55(31-46-20-14-11-15-21-46)95-78(123)58(34-64(108)109)88-44(9)102/h10-23,36,38-43,50-60,66,84,100-101H,24-35,37H2,1-9H3,(H2,82,103)(H2,83,112)(H,85,118)(H,86,119)(H,87,126)(H,88,102)(H,89,116)(H,90,120)(H,91,113)(H,92,114)(H,93,122)(H,94,121)(H,95,123)(H,96,117)(H,97,124)(H,98,115)(H,99,125)(H,104,105)(H,106,107)(H,108,109)(H,110,111)/t40-,41-,42-,43+,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,66-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 6.90E+3 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006671
(CHEMBL3236294)Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(N)=O |r| Show InChI InChI=1S/C79H109N17O26/c1-37(2)27-51(71(114)83-41(7)69(112)95-59(36-97)65(80)108)88-67(110)40(6)84-73(116)53(29-45-19-13-11-14-20-45)91-74(117)55(31-47-35-81-49-24-18-17-23-48(47)49)93-70(113)50(25-26-60(100)101)87-66(109)39(5)82-72(115)52(28-38(3)4)90-77(120)58(34-63(106)107)94-76(119)57(33-62(104)105)89-68(111)42(8)85-79(122)64(43(9)98)96-78(121)54(30-46-21-15-12-16-22-46)92-75(118)56(32-61(102)103)86-44(10)99/h11-24,35,37-43,50-59,64,81,97-98H,25-34,36H2,1-10H3,(H2,80,108)(H,82,115)(H,83,114)(H,84,116)(H,85,122)(H,86,99)(H,87,109)(H,88,110)(H,89,111)(H,90,120)(H,91,117)(H,92,118)(H,93,113)(H,94,119)(H,95,112)(H,96,121)(H,100,101)(H,102,103)(H,104,105)(H,106,107)/t39-,40-,41-,42-,43+,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,64-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 2.80E+4 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006673
(CHEMBL3236296)Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(N)=O |r| Show InChI InChI=1S/C81H112N18O27/c1-38(2)28-52(73(118)85-41(6)70(115)98-60(37-100)67(83)112)91-68(113)40(5)86-74(119)54(30-45-18-12-10-13-19-45)94-76(121)56(32-47-36-84-49-23-17-16-22-48(47)49)96-72(117)50(24-26-61(82)103)89-71(116)51(25-27-62(104)105)90-75(120)53(29-39(3)4)93-79(124)59(35-65(110)111)97-78(123)58(34-64(108)109)92-69(114)42(7)87-81(126)66(43(8)101)99-80(125)55(31-46-20-14-11-15-21-46)95-77(122)57(33-63(106)107)88-44(9)102/h10-23,36,38-43,50-60,66,84,100-101H,24-35,37H2,1-9H3,(H2,82,103)(H2,83,112)(H,85,118)(H,86,119)(H,87,126)(H,88,102)(H,89,116)(H,90,120)(H,91,113)(H,92,114)(H,93,124)(H,94,121)(H,95,122)(H,96,117)(H,97,123)(H,98,115)(H,99,125)(H,104,105)(H,106,107)(H,108,109)(H,110,111)/t40-,41-,42-,43+,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,66-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 2.60E+3 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006674
(CHEMBL3236297)Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(N)=O)NC(=S)Nc1ccc(c(c1)C(O)=O)-c1c2ccc(O)cc2oc2cc(=O)ccc12)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(N)=O |r,wU:93.97,138.146,52.55,13.13,4.3,78.81,127.136,38.41,68.71,wD:133.141,73.76,43.46,8.8,60.63,24.25,82.85,(69.07,-15.6,;67.73,-14.82,;67.73,-13.28,;66.38,-15.6,;66.38,-17.14,;65.04,-17.91,;63.71,-17.14,;63.71,-15.6,;62.38,-17.9,;62.38,-19.45,;61.04,-17.13,;59.71,-17.9,;59.71,-19.45,;58.37,-17.13,;58.37,-15.59,;59.71,-14.81,;59.71,-13.28,;61.04,-12.51,;62.38,-13.28,;62.38,-14.82,;61.04,-15.59,;57.04,-17.9,;55.69,-17.13,;55.69,-15.59,;54.36,-17.89,;54.36,-19.44,;55.69,-20.21,;57.1,-19.59,;58.13,-20.74,;57.35,-22.08,;57.83,-23.54,;56.8,-24.68,;55.3,-24.36,;54.82,-22.9,;55.85,-21.75,;53.02,-17.12,;51.69,-17.89,;51.69,-19.44,;50.35,-17.12,;50.35,-15.58,;49.02,-17.89,;47.68,-17.12,;47.68,-15.58,;46.34,-17.88,;46.34,-19.43,;47.68,-20.2,;47.68,-21.75,;46.34,-22.52,;49.01,-22.52,;45,-17.11,;43.67,-17.88,;43.67,-19.43,;42.33,-17.11,;42.33,-15.57,;43.67,-14.79,;43.67,-13.25,;45,-15.57,;40.99,-17.88,;39.65,-17.11,;39.65,-15.57,;38.33,-17.87,;38.33,-19.42,;39.65,-20.19,;40.99,-19.42,;39.65,-21.74,;36.99,-17.1,;35.64,-17.87,;35.64,-19.42,;34.3,-17.1,;34.3,-15.56,;32.98,-17.87,;31.64,-17.1,;31.64,-15.56,;30.3,-17.86,;30.3,-19.41,;28.96,-17.09,;27.64,-17.86,;27.64,-19.41,;26.3,-17.09,;24.95,-17.86,;23.62,-17.09,;23.62,-15.55,;22.29,-17.85,;22.29,-19.4,;23.62,-20.17,;23.62,-21.72,;24.94,-22.49,;26.29,-21.72,;26.29,-20.18,;24.95,-19.4,;20.95,-17.09,;19.61,-17.85,;19.61,-19.4,;18.28,-17.09,;18.28,-15.54,;19.61,-14.76,;20.95,-15.54,;19.61,-13.22,;16.94,-17.85,;15.63,-17.07,;15.65,-15.53,;14.29,-17.82,;12.97,-17.04,;11.64,-17.78,;10.32,-16.99,;10.34,-15.45,;11.68,-14.71,;13,-15.5,;12.09,-13.23,;13.58,-12.84,;11.01,-12.13,;9.01,-14.66,;7.68,-15.41,;7.66,-16.94,;6.31,-17.68,;5,-16.9,;3.63,-17.64,;5.02,-15.36,;6.36,-14.61,;6.38,-13.08,;7.73,-12.34,;7.75,-10.8,;9.1,-10.05,;9.11,-8.5,;10.41,-10.84,;10.38,-12.38,;9.04,-13.13,;26.3,-15.55,;24.95,-14.78,;27.64,-14.77,;67.73,-17.91,;67.73,-19.46,;69.06,-17.14,;70.39,-17.91,;70.39,-19.46,;71.73,-17.15,;71.73,-15.61,;73.07,-17.92,;74.4,-17.15,;74.4,-15.61,;75.74,-14.83,;75.74,-17.92,;77.07,-17.15,;75.74,-19.47,)| Show InChI InChI=1S/C97H120N20O26S/c1-45(2)33-66(88(133)104-51(9)86(131)115-73(44-118)81(100)126)109-84(129)50(8)105-89(134)68(35-53-19-13-11-14-20-53)113-91(136)70(37-55-43-101-64-24-18-17-23-59(55)64)110-85(130)49(7)103-87(132)65(31-32-78(124)125)108-90(135)67(34-46(3)4)112-92(137)71(41-76(98)122)111-83(128)48(6)102-82(127)47(5)106-95(140)80(52(10)119)117-94(139)69(36-54-21-15-12-16-22-54)114-93(138)72(42-77(99)123)116-97(144)107-56-25-28-60(63(38-56)96(141)142)79-61-29-26-57(120)39-74(61)143-75-40-58(121)27-30-62(75)79/h11-30,38-40,43,45-52,65-73,80,101,118-120H,31-37,41-42,44H2,1-10H3,(H2,98,122)(H2,99,123)(H2,100,126)(H,102,127)(H,103,132)(H,104,133)(H,105,134)(H,106,140)(H,108,135)(H,109,129)(H,110,130)(H,111,128)(H,112,137)(H,113,136)(H,114,138)(H,115,131)(H,117,139)(H,124,125)(H,141,142)(H2,107,116,144)/t47-,48-,49-,50-,51-,52+,65-,66-,67-,68-,69-,70-,71-,72-,73-,80-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 2.10E+4 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006676
(CHEMBL3236298)Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(=S)Nc1ccc(c(c1)C(O)=O)-c1c2ccc(O)cc2oc2cc(=O)ccc12)[C@@H](C)O)C(=O)N[C@@H](C)C(N)=O |r,wU:38.41,4.3,134.143,13.13,56.59,100.104,72.75,85.88,wD:64.67,140.148,8.8,80.83,24.25,47.50,89.92,(65.98,-14.77,;65.98,-16.31,;67.32,-17.08,;64.64,-17.08,;64.64,-18.61,;63.31,-19.39,;61.97,-18.61,;61.97,-17.07,;60.65,-19.38,;60.65,-20.92,;59.3,-18.61,;57.98,-19.38,;57.98,-20.92,;56.65,-18.6,;56.65,-17.07,;57.98,-16.3,;59.31,-17.07,;60.65,-16.31,;60.65,-14.77,;59.31,-13.99,;57.99,-14.76,;55.32,-19.37,;53.98,-18.6,;53.98,-17.06,;52.65,-19.37,;52.65,-20.91,;53.98,-21.68,;55.38,-21.06,;56.41,-22.21,;55.64,-23.54,;56.12,-25,;55.09,-26.15,;53.58,-25.83,;53.1,-24.36,;54.13,-23.21,;51.31,-18.6,;49.98,-19.37,;49.98,-20.91,;48.64,-18.59,;48.64,-17.06,;49.98,-16.29,;49.98,-14.75,;48.65,-13.98,;51.32,-13.98,;47.32,-19.36,;45.98,-18.59,;45.98,-17.05,;44.65,-19.36,;44.65,-20.9,;45.98,-21.67,;45.98,-23.21,;44.64,-23.99,;47.31,-23.98,;43.31,-18.59,;41.98,-19.36,;41.98,-20.9,;40.65,-18.58,;40.65,-17.05,;41.98,-16.28,;41.98,-14.74,;43.32,-17.05,;39.31,-19.35,;37.99,-18.58,;37.99,-17.04,;36.66,-19.35,;36.66,-20.89,;37.99,-21.66,;39.31,-20.89,;37.99,-23.2,;35.32,-18.58,;33.99,-19.35,;33.99,-20.89,;32.65,-18.58,;32.65,-17.04,;33.99,-16.27,;35.33,-17.04,;33.99,-14.73,;31.32,-19.34,;29.98,-18.58,;29.98,-17.03,;28.65,-19.35,;28.65,-20.88,;27.32,-18.57,;25.99,-19.35,;25.99,-20.89,;24.65,-18.57,;23.32,-19.34,;21.99,-18.57,;21.99,-17.03,;20.66,-19.34,;20.66,-20.88,;21.99,-21.65,;23.31,-20.89,;24.64,-21.66,;24.63,-23.2,;23.29,-23.97,;21.98,-23.19,;19.32,-18.57,;17.99,-19.34,;17.99,-20.88,;16.66,-18.57,;16.66,-17.02,;18,-16.26,;19.32,-17.03,;18,-14.72,;15.33,-19.34,;14.01,-18.55,;14.03,-17.01,;12.67,-19.3,;11.34,-18.52,;10.01,-19.26,;8.69,-18.47,;8.7,-16.93,;10.05,-16.18,;11.38,-16.97,;10.46,-14.7,;11.95,-14.31,;9.38,-13.6,;7.37,-16.14,;6.04,-16.88,;6.02,-18.42,;4.66,-19.17,;3.34,-18.38,;1.98,-19.13,;3.37,-16.84,;4.71,-16.09,;4.73,-14.55,;6.09,-13.81,;6.11,-12.26,;7.46,-11.51,;7.47,-9.95,;8.78,-12.31,;8.75,-13.84,;7.4,-14.6,;24.65,-17.03,;23.32,-16.26,;25.99,-16.26,;65.98,-19.39,;65.98,-20.93,;67.31,-18.62,;68.64,-19.39,;68.64,-20.93,;69.97,-18.62,;71.31,-19.4,;69.97,-17.08,)| Show InChI InChI=1S/C97H115N17O30S/c1-45(2)33-65(87(133)100-47(5)82(98)128)106-83(129)48(6)101-88(134)67(35-51-17-11-9-12-18-51)109-90(136)69(37-53-44-99-62-22-16-15-21-57(53)62)111-86(132)64(30-32-76(120)121)104-85(131)63(29-31-75(118)119)105-89(135)66(34-46(3)4)108-92(138)71(42-78(124)125)112-91(137)70(41-77(122)123)107-84(130)49(7)102-95(141)81(50(8)115)114-94(140)68(36-52-19-13-10-14-20-52)110-93(139)72(43-79(126)127)113-97(145)103-54-23-26-58(61(38-54)96(142)143)80-59-27-24-55(116)39-73(59)144-74-40-56(117)25-28-60(74)80/h9-28,38-40,44-50,63-72,81,99,115-116H,29-37,41-43H2,1-8H3,(H2,98,128)(H,100,133)(H,101,134)(H,102,141)(H,104,131)(H,105,135)(H,106,129)(H,107,130)(H,108,138)(H,109,136)(H,110,139)(H,111,132)(H,112,137)(H,114,140)(H,118,119)(H,120,121)(H,122,123)(H,124,125)(H,126,127)(H,142,143)(H2,103,113,145)/t47-,48-,49-,50+,63-,64-,65-,66-,67-,68-,69-,70-,71-,72-,81-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 580 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006678
(CHEMBL3236299)Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(=S)Nc1ccc(c(c1)C(O)=O)-c1c2ccc(O)cc2oc2cc(=O)ccc12)[C@@H](C)O)C(N)=O |r,wU:38.41,100.104,13.13,56.59,85.88,4.3,72.75,134.143,wD:89.92,8.8,24.25,64.67,80.83,47.50,(70,-11.58,;70,-13.12,;71.33,-13.88,;68.66,-13.88,;68.66,-15.42,;67.34,-16.19,;66,-15.42,;66,-13.88,;64.67,-16.19,;64.67,-17.73,;63.34,-15.41,;62,-16.18,;62,-17.73,;60.67,-15.41,;60.67,-13.87,;62,-13.11,;62.01,-11.57,;63.35,-10.8,;64.68,-11.57,;64.68,-13.11,;63.35,-13.88,;59.34,-16.18,;58.01,-15.41,;58.01,-13.87,;56.67,-16.18,;56.67,-17.72,;58.01,-18.48,;59.41,-17.87,;60.45,-19.01,;59.67,-20.34,;60.15,-21.81,;59.11,-22.96,;57.6,-22.63,;57.14,-21.17,;58.16,-20.02,;55.34,-15.4,;54.02,-16.17,;54.02,-17.72,;52.68,-15.4,;52.68,-13.86,;54.02,-13.1,;54.02,-11.56,;52.69,-10.79,;55.35,-10.79,;51.35,-16.17,;50.01,-15.4,;50.01,-13.86,;48.68,-16.17,;48.68,-17.71,;50.01,-18.47,;50.01,-20.01,;48.68,-20.79,;51.34,-20.79,;47.35,-15.39,;46.02,-16.16,;46.02,-17.71,;44.69,-15.39,;44.69,-13.85,;46.02,-13.09,;47.36,-13.85,;46.02,-11.55,;43.36,-16.16,;42.02,-15.39,;42.02,-13.85,;40.69,-16.16,;40.69,-17.7,;42.02,-18.47,;43.35,-17.7,;42.02,-20,;39.36,-15.39,;38.03,-16.16,;38.03,-17.7,;36.69,-15.39,;36.69,-13.84,;38.03,-13.08,;39.36,-13.84,;38.03,-11.54,;35.37,-16.16,;34.03,-15.38,;34.03,-13.84,;32.7,-16.15,;32.7,-17.7,;31.36,-15.38,;30.03,-16.15,;30.03,-17.69,;28.7,-15.38,;27.37,-16.15,;26.04,-15.37,;26.04,-13.84,;24.71,-16.15,;24.71,-17.69,;26.04,-18.45,;27.37,-17.69,;28.7,-18.46,;28.7,-20,;27.36,-20.77,;26.03,-19.99,;23.38,-15.37,;22.04,-16.15,;22.04,-17.68,;20.7,-15.37,;20.7,-13.83,;22.04,-13.07,;23.38,-13.83,;22.04,-11.53,;19.38,-16.14,;18.06,-15.36,;18.08,-13.82,;16.72,-16.11,;15.4,-15.33,;14.07,-16.07,;12.74,-15.28,;12.76,-13.74,;14.1,-12.99,;15.43,-13.78,;14.51,-11.51,;16,-11.12,;13.43,-10.41,;11.43,-12.94,;10.09,-13.69,;10.07,-15.23,;8.71,-15.97,;7.4,-15.19,;6.03,-15.93,;7.42,-13.65,;8.77,-12.9,;8.78,-11.36,;10.14,-10.62,;10.16,-9.07,;11.51,-8.32,;11.52,-6.76,;12.83,-9.12,;12.8,-10.65,;11.46,-11.41,;28.7,-13.84,;27.37,-13.08,;30.03,-13.08,;70,-16.19,;71.33,-15.42,;70,-17.74,)| Show InChI InChI=1S/C94H110N16O29S/c1-44(2)32-63(80(95)124)102-81(125)46(5)97-85(129)65(34-49-16-10-8-11-17-49)105-87(131)67(36-51-43-96-60-21-15-14-20-55(51)60)107-84(128)62(29-31-74(116)117)100-83(127)61(28-30-73(114)115)101-86(130)64(33-45(3)4)104-89(133)69(41-76(120)121)108-88(132)68(40-75(118)119)103-82(126)47(6)98-92(136)79(48(7)111)110-91(135)66(35-50-18-12-9-13-19-50)106-90(134)70(42-77(122)123)109-94(140)99-52-22-25-56(59(37-52)93(137)138)78-57-26-23-53(112)38-71(57)139-72-39-54(113)24-27-58(72)78/h8-27,37-39,43-48,61-70,79,96,111-112H,28-36,40-42H2,1-7H3,(H2,95,124)(H,97,129)(H,98,136)(H,100,127)(H,101,130)(H,102,125)(H,103,126)(H,104,133)(H,105,131)(H,106,134)(H,107,128)(H,108,132)(H,110,135)(H,114,115)(H,116,117)(H,118,119)(H,120,121)(H,122,123)(H,137,138)(H2,99,109,140)/t46-,47-,48+,61-,62-,63-,64-,65-,66-,67-,68-,69-,70-,79-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 330 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006679
(CHEMBL3236300)Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(=S)Nc1ccc(c(c1)C(O)=O)-c1c2ccc(O)cc2oc2cc(=O)ccc12)[C@@H](C)O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](C)C(N)=O |r,wU:16.16,29.29,4.3,116.123,44.45,78.84,93.98,wD:84.89,8.8,33.33,102.107,24.24,127.135,(45.14,-14.1,;43.8,-13.34,;43.8,-11.8,;42.46,-14.1,;42.46,-15.64,;41.13,-16.41,;39.8,-15.64,;39.8,-14.1,;38.47,-16.41,;38.47,-17.95,;39.8,-18.71,;41.13,-17.95,;39.8,-20.26,;37.13,-15.63,;35.81,-16.4,;35.81,-17.95,;34.47,-15.64,;34.47,-14.09,;35.81,-13.33,;37.13,-14.09,;35.81,-11.79,;33.14,-16.41,;31.8,-15.63,;31.8,-14.09,;30.47,-16.41,;30.47,-17.95,;29.14,-15.63,;27.8,-16.4,;27.8,-17.94,;26.47,-15.63,;25.15,-16.4,;23.81,-15.62,;23.81,-14.09,;22.47,-16.4,;22.47,-17.94,;23.81,-18.7,;23.8,-20.24,;25.12,-21.02,;26.45,-20.25,;26.45,-18.71,;25.13,-17.94,;21.14,-15.62,;19.81,-16.4,;19.81,-17.93,;18.48,-15.62,;18.48,-14.08,;19.81,-13.31,;21.15,-14.08,;19.81,-11.78,;17.14,-16.4,;15.82,-15.61,;15.84,-14.07,;14.47,-16.36,;13.15,-15.58,;11.82,-16.32,;10.49,-15.53,;10.51,-13.99,;11.86,-13.24,;13.19,-14.03,;12.27,-11.76,;13.76,-11.37,;11.19,-10.66,;9.18,-13.2,;7.85,-13.94,;7.83,-15.48,;6.47,-16.23,;5.15,-15.44,;3.79,-16.19,;5.18,-13.9,;6.52,-13.15,;6.54,-11.61,;7.9,-10.87,;7.92,-9.32,;9.26,-8.57,;9.28,-7.01,;10.59,-9.37,;10.56,-10.9,;9.21,-11.66,;26.47,-14.09,;25.15,-13.32,;27.8,-13.32,;43.8,-16.41,;43.8,-17.96,;45.13,-15.64,;46.46,-16.42,;46.46,-17.96,;47.8,-18.72,;47.8,-20.27,;46.45,-21.04,;49.12,-21.04,;47.8,-15.65,;47.8,-14.11,;49.13,-16.42,;50.46,-15.65,;50.46,-14.11,;51.79,-13.35,;51.79,-11.81,;50.46,-11.04,;53.14,-11.04,;51.79,-16.42,;51.79,-17.97,;53.13,-15.65,;54.46,-16.43,;54.46,-17.97,;55.79,-18.73,;57.19,-18.12,;58.22,-19.26,;57.46,-20.59,;57.92,-22.06,;56.9,-23.21,;55.39,-22.88,;54.91,-21.42,;55.95,-20.27,;55.79,-15.66,;55.79,-14.12,;57.12,-16.43,;58.46,-15.66,;58.46,-14.12,;59.79,-13.36,;59.79,-11.82,;61.13,-11.05,;62.46,-11.82,;62.46,-13.36,;61.12,-14.13,;59.79,-16.43,;59.79,-17.98,;61.12,-15.66,;62.45,-16.44,;62.45,-17.98,;63.79,-15.67,;65.13,-16.44,;63.79,-14.13,)| Show InChI InChI=1S/C88H99N15O28S/c1-41(2)30-59(80(122)95-57(26-28-68(107)108)77(119)94-58(27-29-69(109)110)78(120)100-62(33-47-40-90-56-19-13-12-18-51(47)56)81(123)98-60(31-45-14-8-6-9-15-45)79(121)91-42(3)75(89)117)97-83(125)64(38-71(113)114)101-82(124)63(37-70(111)112)96-76(118)43(4)92-86(128)74(44(5)104)103-85(127)61(32-46-16-10-7-11-17-46)99-84(126)65(39-72(115)116)102-88(132)93-48-20-23-52(55(34-48)87(129)130)73-53-24-21-49(105)35-66(53)131-67-36-50(106)22-25-54(67)73/h6-25,34-36,40-44,57-65,74,90,104-105H,26-33,37-39H2,1-5H3,(H2,89,117)(H,91,121)(H,92,128)(H,94,119)(H,95,122)(H,96,118)(H,97,125)(H,98,123)(H,99,126)(H,100,120)(H,101,124)(H,103,127)(H,107,108)(H,109,110)(H,111,112)(H,113,114)(H,115,116)(H,129,130)(H2,93,102,132)/t42-,43-,44+,57-,58-,59-,60-,61-,62-,63-,64-,65-,74-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 910 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006680
(CHEMBL3236301)Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(Cl)c(Cl)c1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(=S)Nc1ccc(c(c1)C(O)=O)-c1c2ccc(O)cc2oc2cc(=O)ccc12)[C@@H](C)O)C(N)=O |r,wU:74.77,87.90,13.13,136.145,102.106,40.43,58.61,4.3,wD:26.27,8.8,91.94,82.85,66.69,49.52,(61.33,-8.28,;61.33,-9.81,;62.67,-10.58,;60,-10.58,;60,-12.12,;58.67,-12.89,;57.33,-12.12,;57.33,-10.58,;55.99,-12.89,;55.99,-14.43,;54.66,-12.11,;53.33,-12.89,;53.33,-14.43,;51.99,-12.11,;51.99,-10.57,;53.33,-9.8,;54.67,-10.58,;56,-9.81,;56,-8.27,;57.34,-7.51,;54.67,-7.49,;54.68,-5.96,;53.33,-8.27,;50.66,-12.88,;49.33,-12.11,;49.33,-10.57,;48,-12.88,;48,-14.42,;49.33,-15.19,;50.73,-14.57,;51.76,-15.72,;50.99,-17.05,;51.46,-18.51,;50.43,-19.67,;48.92,-19.35,;48.44,-17.88,;49.49,-16.72,;46.66,-12.1,;45.32,-12.88,;45.32,-14.42,;43.99,-12.1,;43.99,-10.56,;45.32,-9.79,;45.32,-8.26,;43.99,-7.48,;46.66,-7.48,;42.66,-12.87,;41.32,-12.1,;41.32,-10.56,;39.98,-12.87,;39.98,-14.41,;41.32,-15.18,;41.32,-16.72,;39.98,-17.5,;42.65,-17.49,;38.65,-12.09,;37.32,-12.87,;37.32,-14.41,;35.98,-12.09,;35.98,-10.55,;37.32,-9.78,;37.32,-8.25,;38.66,-10.55,;34.64,-12.86,;33.31,-12.09,;33.31,-10.55,;31.98,-12.86,;31.98,-14.4,;33.31,-15.17,;34.64,-14.4,;33.31,-16.71,;30.64,-12.08,;29.31,-12.86,;29.31,-14.4,;27.98,-12.08,;27.98,-10.54,;29.31,-9.77,;30.65,-10.54,;29.31,-8.24,;26.63,-12.85,;25.29,-12.08,;25.29,-10.54,;23.96,-12.85,;23.96,-14.39,;22.63,-12.07,;21.3,-12.85,;21.3,-14.39,;19.96,-12.07,;18.63,-12.84,;17.3,-12.07,;17.3,-10.53,;15.96,-12.84,;15.96,-14.38,;17.3,-15.15,;18.62,-14.39,;19.94,-15.16,;19.93,-16.7,;18.6,-17.47,;17.29,-16.69,;14.64,-12.07,;13.3,-12.84,;13.3,-14.38,;11.96,-12.07,;11.96,-10.52,;13.3,-9.75,;14.63,-10.52,;13.3,-8.22,;10.62,-12.84,;9.31,-12.06,;9.33,-10.53,;7.97,-12.81,;6.66,-12.03,;5.33,-12.77,;4.01,-11.98,;4.03,-10.44,;5.37,-9.7,;6.69,-10.49,;5.78,-8.22,;7.26,-7.83,;4.7,-7.13,;2.7,-9.65,;1.37,-10.4,;1.35,-11.93,;0,-12.67,;-1.32,-11.89,;-2.67,-12.63,;-1.29,-10.35,;.06,-9.61,;.07,-8.07,;1.42,-7.34,;1.44,-5.8,;2.79,-5.05,;2.8,-3.5,;4.1,-5.84,;4.07,-7.37,;2.73,-8.12,;19.96,-10.53,;18.63,-9.77,;21.3,-9.76,;61.33,-12.9,;62.67,-12.12,;61.33,-14.44,)| Show InChI InChI=1S/C94H108Cl2N16O29S/c1-42(2)29-63(80(97)126)104-81(127)44(5)99-85(131)66(33-48-17-24-58(95)59(96)31-48)108-87(133)67(34-49-41-98-60-16-12-11-15-53(49)60)109-84(130)62(26-28-74(118)119)102-83(129)61(25-27-73(116)117)103-86(132)64(30-43(3)4)106-89(135)69(39-76(122)123)110-88(134)68(38-75(120)121)105-82(128)45(6)100-92(138)79(46(7)113)112-91(137)65(32-47-13-9-8-10-14-47)107-90(136)70(40-77(124)125)111-94(142)101-50-18-21-54(57(35-50)93(139)140)78-55-22-19-51(114)36-71(55)141-72-37-52(115)20-23-56(72)78/h8-24,31,35-37,41-46,61-70,79,98,113-114H,25-30,32-34,38-40H2,1-7H3,(H2,97,126)(H,99,131)(H,100,138)(H,102,129)(H,103,132)(H,104,127)(H,105,128)(H,106,135)(H,107,136)(H,108,133)(H,109,130)(H,110,134)(H,112,137)(H,116,117)(H,118,119)(H,120,121)(H,122,123)(H,124,125)(H,139,140)(H2,101,111,142)/t44-,45-,46+,61-,62-,63-,64-,65-,66-,67-,68-,69-,70-,79-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | 22 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006681
(CHEMBL3236302)Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@]1(C)CCC\C=C/CCC[C@@](C)(NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(O)=O)NC(=S)Nc2ccc(c(c2)C(O)=O)-c2c3ccc(O)cc3oc3cc(=O)ccc23)[C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(O)=O)C(=O)N1)C(O)=O |r,wU:58.61,4.3,48.51,38.41,73.77,107.116,121.129,13.13,wD:24.25,53.56,129.137,8.8,62.65,113.121,c:46,(75.65,-17.81,;74.32,-17.04,;74.32,-15.51,;72.98,-17.81,;72.98,-19.34,;71.66,-20.11,;70.33,-19.34,;70.33,-17.81,;69,-20.11,;69,-21.65,;67.67,-19.33,;66.34,-20.1,;66.34,-21.65,;65.01,-19.33,;65.01,-17.8,;66.34,-17.03,;67.67,-17.81,;69.01,-17.04,;69.01,-15.51,;67.68,-14.73,;66.35,-15.5,;63.67,-20.1,;62.34,-19.33,;62.34,-17.8,;61.01,-20.1,;61.01,-21.64,;62.34,-22.4,;63.75,-21.78,;64.77,-22.92,;64,-24.26,;64.48,-25.72,;63.45,-26.86,;61.94,-26.54,;61.47,-25.07,;62.5,-23.93,;59.69,-19.32,;58.36,-20.09,;58.36,-21.63,;57.02,-19.32,;58.11,-18.22,;56.25,-17.98,;57.01,-16.65,;56.25,-15.32,;57.01,-13.99,;56.25,-12.66,;43.32,-15.92,;42.93,-17.41,;41.45,-17.81,;41.06,-19.3,;40.28,-17.96,;39.74,-20.08,;38.4,-19.3,;38.4,-17.77,;37.07,-20.07,;37.07,-21.61,;35.74,-19.29,;34.41,-20.07,;34.41,-21.6,;33.07,-19.29,;31.75,-20.06,;30.42,-19.29,;30.42,-17.76,;29.09,-20.06,;29.09,-21.6,;30.42,-22.36,;31.74,-21.6,;33.07,-22.37,;33.07,-23.9,;31.74,-24.67,;30.42,-23.9,;27.76,-19.28,;26.42,-20.06,;26.42,-21.59,;25.09,-19.28,;25.09,-17.75,;26.42,-16.99,;27.77,-17.75,;26.42,-15.45,;23.76,-20.06,;22.38,-19.24,;22.4,-17.62,;20.97,-20.02,;19.58,-19.2,;18.19,-19.98,;16.8,-19.15,;16.82,-17.53,;18.23,-16.75,;19.62,-17.58,;18.66,-15.2,;20.22,-14.79,;17.53,-14.05,;15.42,-16.7,;14.02,-17.49,;14,-19.1,;12.58,-19.88,;11.2,-19.06,;9.76,-19.84,;11.22,-17.44,;12.63,-16.65,;12.65,-15.04,;14.07,-14.27,;14.09,-12.64,;15.51,-11.85,;15.52,-10.22,;16.89,-12.69,;16.86,-14.3,;15.45,-15.09,;33.07,-17.76,;31.75,-17,;34.41,-17,;42.39,-20.08,;42.39,-21.61,;43.72,-19.3,;45.05,-20.08,;45.05,-21.62,;46.38,-22.39,;47.71,-21.62,;46.38,-23.92,;46.38,-19.31,;46.38,-17.78,;47.71,-20.09,;49.04,-19.31,;49.04,-17.78,;50.37,-17.01,;51.7,-17.78,;50.37,-15.48,;50.37,-20.09,;50.37,-21.62,;51.7,-19.31,;53.04,-20.09,;53.04,-21.63,;54.36,-22.39,;54.36,-23.93,;53.03,-24.7,;55.69,-24.7,;54.36,-19.32,;54.36,-17.79,;55.7,-20.09,;74.32,-20.11,;75.64,-19.34,;74.32,-21.66,)| Show InChI InChI=1S/C99H119N15O26S/c1-51(2)40-69-86(127)104-68(36-37-78(118)119)91(132)114-99(9,96(139)109-72(44-58-50-100-67-29-21-20-28-62(58)67)87(128)106-70(42-56-24-16-14-17-25-56)85(126)101-53(5)83(124)108-75(94(136)137)41-52(3)4)39-23-13-11-10-12-22-38-98(8,95(138)110-73(48-79(120)121)88(129)105-69)113-84(125)54(6)102-92(133)82(55(7)115)112-90(131)71(43-57-26-18-15-19-27-57)107-89(130)74(49-80(122)123)111-97(141)103-59-30-33-63(66(45-59)93(134)135)81-64-34-31-60(116)46-76(64)140-77-47-61(117)32-35-65(77)81/h10-11,14-21,24-35,45-47,50-55,68-75,82,100,115-116H,12-13,22-23,36-44,48-49H2,1-9H3,(H,101,126)(H,102,133)(H,104,127)(H,105,129)(H,106,128)(H,107,130)(H,108,124)(H,109,139)(H,110,138)(H,112,131)(H,113,125)(H,114,132)(H,118,119)(H,120,121)(H,122,123)(H,134,135)(H,136,137)(H2,103,111,141)/b11-10-/t53-,54-,55+,68-,69-,70-,71-,72-,73-,74-,75-,82-,98+,99+/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | 570 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006682
(CHEMBL3236303)Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@]1(C)CCC\C=C/CCC[C@@](C)(NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=S)Nc2ccc(c(c2)C(O)=O)-c2c3ccc(O)cc3oc3cc(=O)ccc23)[C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(O)=O)C(=O)N1)C(O)=O |r,wU:13.13,107.116,38.41,58.61,4.3,73.77,121.129,48.51,wD:53.56,62.65,113.121,24.25,129.137,8.8,c:46,(67.2,-15.63,;67.2,-17.16,;68.54,-17.92,;65.87,-17.92,;65.87,-19.45,;64.55,-20.22,;63.22,-19.45,;63.22,-17.92,;61.89,-20.22,;61.89,-21.76,;60.56,-19.45,;59.23,-20.22,;59.23,-21.76,;57.9,-19.44,;57.9,-17.92,;59.23,-17.15,;60.56,-17.92,;61.9,-17.15,;61.9,-15.62,;60.57,-14.84,;59.24,-15.62,;56.57,-20.21,;55.23,-19.44,;55.23,-17.91,;53.9,-20.21,;53.9,-21.75,;55.23,-22.51,;56.64,-21.9,;57.66,-23.03,;56.89,-24.37,;57.38,-25.83,;56.34,-26.97,;54.83,-26.65,;54.37,-25.18,;55.39,-24.05,;52.58,-19.44,;51.25,-20.2,;51.25,-21.75,;49.92,-19.43,;51.01,-18.33,;49.15,-18.09,;49.91,-16.76,;49.14,-15.44,;49.91,-14.11,;49.14,-12.78,;36.22,-16.04,;35.83,-17.51,;34.35,-17.92,;33.96,-19.41,;33.18,-18.08,;32.64,-20.19,;31.31,-19.41,;31.31,-17.88,;29.97,-20.18,;29.97,-21.72,;28.64,-19.41,;27.31,-20.18,;27.31,-21.72,;25.98,-19.4,;24.65,-20.18,;23.33,-19.4,;23.33,-17.87,;22,-20.18,;22,-21.71,;23.33,-22.48,;24.65,-21.71,;25.98,-22.48,;25.98,-24.01,;24.65,-24.78,;23.32,-24.01,;20.67,-19.4,;19.34,-20.18,;19.34,-21.71,;18,-19.4,;18,-17.86,;19.34,-17.1,;20.68,-17.86,;19.34,-15.57,;16.67,-20.18,;15.29,-19.36,;15.31,-17.74,;13.88,-20.14,;12.5,-19.32,;11.1,-20.1,;9.71,-19.27,;9.73,-17.66,;11.14,-16.87,;12.53,-17.7,;11.57,-15.32,;13.13,-14.91,;10.44,-14.17,;8.33,-16.82,;6.93,-17.61,;6.91,-19.22,;5.49,-20,;4.11,-19.18,;2.68,-19.96,;4.14,-17.56,;5.55,-16.77,;5.56,-15.16,;6.99,-14.39,;7.01,-12.77,;8.42,-11.98,;8.44,-10.34,;9.81,-12.81,;9.77,-14.42,;8.37,-15.21,;25.98,-17.87,;24.65,-17.12,;27.31,-17.11,;35.29,-20.19,;35.29,-21.73,;36.62,-19.42,;37.95,-20.2,;37.95,-21.73,;39.28,-22.49,;40.61,-21.73,;39.28,-24.03,;39.28,-19.42,;39.28,-17.89,;40.61,-20.2,;41.94,-19.42,;41.94,-17.9,;43.27,-17.12,;44.61,-17.9,;43.27,-15.6,;43.27,-20.2,;43.27,-21.74,;44.6,-19.43,;45.93,-20.21,;45.93,-21.74,;47.26,-22.5,;47.26,-24.04,;45.93,-24.81,;48.59,-24.81,;47.26,-19.43,;47.26,-17.9,;48.59,-20.2,;67.2,-20.23,;68.53,-19.46,;67.2,-21.77,)| Show InChI InChI=1S/C99H120N16O25S/c1-51(2)40-69-86(127)105-68(36-37-79(120)121)91(132)115-99(9,96(139)110-72(44-58-50-101-67-29-21-20-28-62(58)67)87(128)107-70(42-56-24-16-14-17-25-56)85(126)102-53(5)83(124)109-75(94(136)137)41-52(3)4)39-23-13-11-10-12-22-38-98(8,95(138)111-74(49-80(122)123)89(130)106-69)114-84(125)54(6)103-92(133)82(55(7)116)113-90(131)71(43-57-26-18-15-19-27-57)108-88(129)73(48-78(100)119)112-97(141)104-59-30-33-63(66(45-59)93(134)135)81-64-34-31-60(117)46-76(64)140-77-47-61(118)32-35-65(77)81/h10-11,14-21,24-35,45-47,50-55,68-75,82,101,116-117H,12-13,22-23,36-44,48-49H2,1-9H3,(H2,100,119)(H,102,126)(H,103,133)(H,105,127)(H,106,130)(H,107,128)(H,108,129)(H,109,124)(H,110,139)(H,111,138)(H,113,131)(H,114,125)(H,115,132)(H,120,121)(H,122,123)(H,134,135)(H,136,137)(H2,104,112,141)/b11-10-/t53-,54-,55+,68-,69-,70-,71-,72-,73-,74-,75-,82-,98+,99+/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.50E+3 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006672
(CHEMBL3236295)Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(N)=O |r| Show InChI InChI=1S/C79H109N17O26/c1-37(2)27-51(71(114)83-41(7)69(112)95-59(36-97)65(80)108)88-66(109)40(6)84-72(115)53(29-45-19-13-11-14-20-45)92-74(117)55(31-47-35-81-49-24-18-17-23-48(47)49)89-67(110)39(5)82-70(113)50(25-26-60(100)101)87-73(116)52(28-38(3)4)91-77(120)58(34-63(106)107)94-76(119)57(33-62(104)105)90-68(111)42(8)85-79(122)64(43(9)98)96-78(121)54(30-46-21-15-12-16-22-46)93-75(118)56(32-61(102)103)86-44(10)99/h11-24,35,37-43,50-59,64,81,97-98H,25-34,36H2,1-10H3,(H2,80,108)(H,82,113)(H,83,114)(H,84,115)(H,85,122)(H,86,99)(H,87,116)(H,88,109)(H,89,110)(H,90,111)(H,91,120)(H,92,117)(H,93,118)(H,94,119)(H,95,112)(H,96,121)(H,100,101)(H,102,103)(H,104,105)(H,106,107)/t39-,40-,41-,42-,43+,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,64-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 2.40E+3 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006723
(CHEMBL3236542)Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@]1(C)CCC\C=C/CCC[C@@](C)(NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(O)=O)NC(=S)Nc2ccc(c(c2)C(O)=O)-c2c3ccc(O)cc3oc3cc(=O)ccc23)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(O)=O)C(=O)N1)C(O)=O |r,wU:73.77,38.41,13.13,121.129,107.116,58.61,4.3,48.51,wD:62.65,113.121,24.25,129.137,53.56,8.8,c:46,(64.25,-11.74,;62.92,-10.98,;62.92,-9.45,;61.58,-11.74,;61.58,-13.27,;60.26,-14.04,;58.93,-13.27,;58.93,-11.74,;57.61,-14.04,;57.61,-15.58,;56.27,-13.27,;54.95,-14.03,;54.95,-15.58,;53.61,-13.26,;53.61,-11.74,;54.95,-10.96,;54.95,-9.44,;56.28,-8.66,;57.61,-9.44,;57.61,-10.97,;56.28,-11.74,;52.29,-14.03,;50.94,-13.26,;50.94,-11.73,;49.62,-14.03,;49.62,-15.57,;50.94,-16.33,;52.35,-15.72,;53.38,-16.85,;52.6,-18.19,;53.09,-19.65,;52.05,-20.79,;50.55,-20.47,;50.08,-19,;51.1,-17.86,;48.29,-13.26,;46.96,-14.02,;46.96,-15.57,;45.63,-13.25,;46.72,-12.15,;44.86,-11.91,;45.62,-10.58,;44.86,-9.25,;45.62,-7.92,;44.85,-6.6,;31.93,-9.85,;31.54,-11.33,;30.06,-11.74,;29.67,-13.23,;28.89,-11.9,;28.35,-14.01,;27.02,-13.23,;27.02,-11.7,;25.68,-14,;25.68,-15.54,;24.35,-13.22,;23.02,-14,;23.02,-15.53,;21.69,-13.22,;20.36,-14,;19.04,-13.22,;19.04,-11.69,;17.71,-13.99,;17.71,-15.53,;19.04,-16.3,;20.36,-15.53,;21.69,-16.3,;21.69,-17.83,;20.36,-18.6,;19.03,-17.83,;16.38,-13.22,;15.05,-13.99,;15.05,-15.52,;13.71,-13.22,;13.71,-11.68,;15.05,-10.92,;16.38,-11.68,;15.05,-9.38,;12.38,-13.99,;11,-13.17,;11.02,-11.56,;9.59,-13.96,;8.21,-13.13,;6.81,-13.91,;5.42,-13.09,;5.44,-11.47,;6.85,-10.69,;8.24,-11.52,;7.28,-9.13,;8.84,-8.72,;6.15,-7.98,;4.04,-10.64,;2.64,-11.42,;2.62,-13.03,;1.2,-13.82,;-.19,-12.99,;-1.61,-13.77,;-.15,-11.37,;1.26,-10.59,;1.27,-8.97,;2.7,-8.2,;2.72,-6.58,;4.13,-5.79,;4.15,-4.16,;5.52,-6.63,;5.48,-8.24,;4.08,-9.03,;21.69,-11.69,;20.36,-10.93,;23.02,-10.93,;31,-14.01,;31,-15.55,;32.33,-13.24,;33.66,-14.01,;33.66,-15.55,;34.99,-16.31,;36.32,-15.55,;34.99,-17.85,;34.99,-13.24,;34.99,-11.71,;36.32,-14.02,;37.65,-13.24,;37.65,-11.71,;38.98,-10.94,;40.32,-11.71,;38.98,-9.42,;38.98,-14.02,;38.98,-15.56,;40.31,-13.25,;41.64,-14.03,;41.64,-15.56,;42.97,-16.32,;42.97,-17.86,;41.64,-18.63,;44.3,-18.63,;42.97,-13.25,;42.97,-11.72,;44.3,-14.02,;62.92,-14.05,;64.24,-13.28,;62.92,-15.59,)| Show InChI InChI=1S/C99H120N16O25S/c1-51(2)40-69-86(127)105-68(36-37-79(120)121)91(132)115-99(9,96(139)110-72(44-58-50-101-67-29-21-20-28-62(58)67)87(128)107-70(42-56-24-16-14-17-25-56)85(126)102-53(5)83(124)109-75(94(136)137)41-52(3)4)39-23-13-11-10-12-22-38-98(8,95(138)111-73(48-78(100)119)88(129)106-69)114-84(125)54(6)103-92(133)82(55(7)116)113-90(131)71(43-57-26-18-15-19-27-57)108-89(130)74(49-80(122)123)112-97(141)104-59-30-33-63(66(45-59)93(134)135)81-64-34-31-60(117)46-76(64)140-77-47-61(118)32-35-65(77)81/h10-11,14-21,24-35,45-47,50-55,68-75,82,101,116-117H,12-13,22-23,36-44,48-49H2,1-9H3,(H2,100,119)(H,102,126)(H,103,133)(H,105,127)(H,106,129)(H,107,128)(H,108,130)(H,109,124)(H,110,139)(H,111,138)(H,113,131)(H,114,125)(H,115,132)(H,120,121)(H,122,123)(H,134,135)(H,136,137)(H2,104,112,141)/b11-10-/t53-,54-,55+,68-,69-,70-,71-,72-,73-,74-,75-,82-,98+,99+/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | 3.70E+3 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006724
(CHEMBL3236543)Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@]1(C)CCC\C=C/CCC[C@@](C)(NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=S)Nc2ccc(c(c2)C(O)=O)-c2c3ccc(O)cc3oc3cc(=O)ccc23)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(O)=O)C(=O)N1)C(O)=O |r,wU:58.61,4.3,73.77,38.41,121.129,48.51,13.13,107.116,wD:113.121,24.25,53.56,8.8,129.137,62.65,c:46,(67.85,-15.26,;66.52,-14.5,;66.52,-12.97,;65.19,-15.26,;65.19,-16.8,;63.86,-17.57,;62.53,-16.8,;62.53,-15.27,;61.21,-17.56,;61.21,-19.11,;59.87,-16.79,;58.55,-17.56,;58.55,-19.1,;57.21,-16.79,;57.21,-15.26,;58.55,-14.49,;59.88,-15.27,;61.21,-14.5,;61.21,-12.97,;59.88,-12.19,;58.55,-12.96,;55.89,-17.56,;54.55,-16.79,;54.55,-15.26,;53.22,-17.55,;53.22,-19.1,;54.55,-19.85,;55.95,-19.24,;56.98,-20.37,;56.21,-21.71,;56.69,-23.17,;55.65,-24.31,;54.15,-24,;53.68,-22.53,;54.7,-21.39,;51.89,-16.78,;50.57,-17.55,;50.57,-19.09,;49.23,-16.78,;50.32,-15.68,;48.46,-15.44,;49.23,-14.11,;48.46,-12.78,;49.22,-11.45,;48.46,-10.12,;35.53,-13.38,;35.15,-14.86,;33.66,-15.26,;33.28,-16.76,;32.5,-15.42,;31.96,-17.53,;30.62,-16.75,;30.62,-15.23,;29.29,-17.53,;29.29,-19.06,;27.96,-16.75,;26.63,-17.53,;26.63,-19.06,;25.3,-16.75,;23.97,-17.52,;22.64,-16.74,;22.64,-15.22,;21.32,-17.52,;21.32,-19.05,;22.64,-19.82,;22.64,-21.36,;23.96,-22.13,;25.29,-21.36,;25.3,-19.83,;23.97,-19.06,;19.99,-16.74,;18.66,-17.52,;18.66,-19.05,;17.32,-16.74,;17.32,-15.21,;18.66,-14.45,;19.99,-15.21,;18.66,-12.91,;15.99,-17.52,;14.6,-16.69,;14.62,-15.08,;13.2,-17.48,;11.81,-16.66,;10.42,-17.44,;9.03,-16.61,;9.05,-14.99,;10.46,-14.21,;11.85,-15.04,;10.89,-12.66,;12.45,-12.25,;9.75,-11.51,;7.65,-14.16,;6.25,-14.95,;6.23,-16.55,;4.81,-17.34,;3.43,-16.52,;2,-17.3,;3.46,-14.9,;4.87,-14.11,;4.88,-12.5,;6.31,-11.73,;6.32,-10.11,;7.74,-9.31,;7.75,-7.68,;9.12,-10.15,;9.09,-11.76,;7.68,-12.55,;25.3,-15.22,;23.97,-14.46,;26.63,-14.46,;34.61,-17.54,;34.61,-19.07,;35.94,-16.76,;37.27,-17.54,;37.27,-19.07,;38.6,-19.83,;39.92,-19.07,;38.6,-21.38,;38.6,-16.76,;38.6,-15.24,;39.93,-17.54,;41.26,-16.77,;41.26,-15.24,;42.59,-14.47,;43.92,-15.24,;42.59,-12.94,;42.59,-17.55,;42.59,-19.08,;43.92,-16.77,;45.25,-17.55,;45.25,-19.08,;46.58,-19.84,;46.58,-21.39,;45.24,-22.16,;47.9,-22.15,;46.58,-16.77,;46.58,-15.25,;47.91,-17.55,;66.52,-17.57,;67.85,-16.8,;66.52,-19.11,)| Show InChI InChI=1S/C99H121N17O24S/c1-51(2)40-69-86(127)106-68(36-37-80(122)123)91(132)116-99(9,96(139)111-72(44-58-50-102-67-29-21-20-28-62(58)67)87(128)108-70(42-56-24-16-14-17-25-56)85(126)103-53(5)83(124)110-75(94(136)137)41-52(3)4)39-23-13-11-10-12-22-38-98(8,95(138)112-73(48-78(100)120)88(129)107-69)115-84(125)54(6)104-92(133)82(55(7)117)114-90(131)71(43-57-26-18-15-19-27-57)109-89(130)74(49-79(101)121)113-97(141)105-59-30-33-63(66(45-59)93(134)135)81-64-34-31-60(118)46-76(64)140-77-47-61(119)32-35-65(77)81/h10-11,14-21,24-35,45-47,50-55,68-75,82,102,117-118H,12-13,22-23,36-44,48-49H2,1-9H3,(H2,100,120)(H2,101,121)(H,103,126)(H,104,133)(H,106,127)(H,107,129)(H,108,128)(H,109,130)(H,110,124)(H,111,139)(H,112,138)(H,114,131)(H,115,125)(H,116,132)(H,122,123)(H,134,135)(H,136,137)(H2,105,113,141)/b11-10-/t53-,54-,55+,68-,69-,70-,71-,72-,73-,74-,75-,82-,98+,99+/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 7.40E+3 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006725
(CHEMBL3236544)Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(Cl)c(Cl)c1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@]1(C)CCC\C=C/CCC[C@@](C)(NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=S)Nc2ccc(c(c2)C(O)=O)-c2c3ccc(O)cc3oc3cc(=O)ccc23)[C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(O)=O)C(=O)N1)C(O)=O |r,wU:50.53,40.43,109.118,123.131,60.63,75.79,13.13,4.3,wD:8.8,26.27,55.58,115.123,64.67,131.139,c:48,(73.25,-15.83,;71.91,-15.06,;71.91,-13.53,;70.58,-15.83,;70.58,-17.36,;69.25,-18.13,;67.93,-17.36,;67.93,-15.83,;66.6,-18.13,;66.6,-19.67,;65.26,-17.35,;63.94,-18.12,;63.94,-19.67,;62.6,-17.35,;62.6,-15.82,;63.94,-15.05,;65.27,-15.83,;66.6,-15.06,;66.6,-13.52,;67.94,-12.76,;65.27,-12.74,;65.27,-11.21,;63.94,-13.52,;61.26,-18.12,;59.93,-17.35,;59.93,-15.82,;58.6,-18.12,;58.6,-19.66,;59.93,-20.42,;61.34,-19.81,;62.36,-20.94,;61.59,-22.28,;62.08,-23.74,;61.04,-24.88,;59.53,-24.56,;59.07,-23.09,;60.09,-21.96,;57.28,-17.34,;55.95,-18.11,;55.95,-19.66,;54.61,-17.34,;55.7,-16.24,;53.84,-16,;54.6,-14.67,;53.84,-13.34,;54.6,-12.01,;53.83,-10.68,;40.9,-13.94,;40.51,-15.42,;39.03,-15.83,;38.64,-17.32,;37.86,-15.98,;37.32,-18.1,;35.98,-17.32,;35.98,-15.79,;34.65,-18.09,;34.65,-19.63,;33.32,-17.31,;31.99,-18.09,;31.99,-19.62,;30.65,-17.31,;29.33,-18.08,;28,-17.31,;28,-15.78,;26.67,-18.08,;26.67,-19.62,;28,-20.39,;28,-21.92,;29.32,-22.69,;30.65,-21.92,;30.65,-20.39,;29.32,-19.62,;25.34,-17.3,;24,-18.08,;24,-19.61,;22.67,-17.3,;22.67,-15.77,;24,-15.01,;25.34,-15.77,;24,-13.47,;21.34,-18.08,;19.95,-17.26,;19.97,-15.64,;18.54,-18.04,;17.16,-17.22,;15.76,-18,;14.37,-17.17,;14.39,-15.55,;15.8,-14.77,;17.19,-15.6,;16.23,-13.22,;17.8,-12.8,;15.1,-12.06,;12.99,-14.72,;11.59,-15.51,;11.57,-17.12,;10.15,-17.9,;8.77,-17.08,;7.33,-17.86,;8.79,-15.46,;10.2,-14.67,;10.22,-13.06,;11.65,-12.28,;11.66,-10.66,;13.08,-9.87,;13.1,-8.24,;14.47,-10.71,;14.43,-12.32,;13.02,-13.11,;30.65,-15.78,;29.33,-15.02,;31.99,-15.02,;39.97,-18.1,;39.97,-19.63,;41.3,-17.32,;42.64,-18.1,;42.64,-19.64,;43.96,-20.41,;45.29,-19.64,;43.96,-21.94,;43.96,-17.33,;43.96,-15.8,;45.3,-18.11,;46.63,-17.33,;46.63,-15.8,;47.96,-15.03,;47.96,-13.5,;49.29,-15.8,;47.96,-18.11,;47.96,-19.64,;49.29,-17.33,;50.62,-18.11,;50.62,-19.65,;51.95,-20.41,;51.95,-21.95,;50.62,-22.72,;53.28,-22.72,;51.95,-17.34,;51.95,-15.81,;53.29,-18.12,;71.91,-18.13,;73.24,-17.36,;71.91,-19.68,)| Show InChI InChI=1S/C99H118Cl2N16O25S/c1-49(2)37-69-86(129)107-68(33-34-79(122)123)91(134)117-99(9,96(141)112-72(42-56-48-103-67-24-18-17-23-60(56)67)87(130)110-71(41-55-25-32-65(100)66(101)39-55)85(128)104-51(5)83(126)111-75(94(138)139)38-50(3)4)36-20-13-11-10-12-19-35-98(8,95(140)113-74(47-80(124)125)89(132)108-69)116-84(127)52(6)105-92(135)82(53(7)118)115-90(133)70(40-54-21-15-14-16-22-54)109-88(131)73(46-78(102)121)114-97(143)106-57-26-29-61(64(43-57)93(136)137)81-62-30-27-58(119)44-76(62)142-77-45-59(120)28-31-63(77)81/h10-11,14-18,21-32,39,43-45,48-53,68-75,82,103,118-119H,12-13,19-20,33-38,40-42,46-47H2,1-9H3,(H2,102,121)(H,104,128)(H,105,135)(H,107,129)(H,108,132)(H,109,131)(H,110,130)(H,111,126)(H,112,141)(H,113,140)(H,115,133)(H,116,127)(H,117,134)(H,122,123)(H,124,125)(H,136,137)(H,138,139)(H2,106,114,143)/b11-10-/t51-,52-,53+,68-,69-,70-,71-,72-,73-,74-,75-,82-,98+,99+/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
MMDB
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | 48 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006726
(CHEMBL3236545)Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(Cl)c(Cl)c1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@]1(C)CCC\C=C/CCC[C@@](C)(NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=S)Nc2ccc(c(c2)C(O)=O)-c2c3ccc(O)cc3oc3cc(=O)ccc23)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(O)=O)C(=O)N1)C(O)=O |r,wU:123.131,109.118,60.63,4.3,75.79,13.13,50.53,40.43,wD:115.123,131.139,64.67,55.58,26.27,8.8,c:48,(68.86,-13.3,;68.86,-14.83,;70.19,-15.6,;67.52,-15.6,;67.52,-17.13,;66.19,-17.9,;64.87,-17.12,;64.87,-15.59,;63.54,-17.89,;63.54,-19.44,;62.2,-17.12,;60.88,-17.89,;60.88,-19.43,;59.54,-17.12,;59.54,-15.59,;60.88,-14.82,;62.21,-15.59,;63.54,-14.82,;63.54,-13.29,;64.88,-12.53,;62.21,-12.51,;62.22,-10.97,;60.88,-13.29,;58.21,-17.88,;56.87,-17.11,;56.87,-15.58,;55.54,-17.88,;55.54,-19.42,;56.87,-20.19,;58.28,-19.57,;59.31,-20.71,;58.53,-22.04,;59.02,-23.51,;57.98,-24.65,;56.47,-24.33,;56.01,-22.86,;57.03,-21.72,;54.22,-17.11,;52.89,-17.88,;52.89,-19.42,;51.55,-17.11,;52.64,-16,;50.78,-15.76,;51.54,-14.43,;50.78,-13.1,;51.54,-11.77,;50.78,-10.44,;37.84,-13.7,;37.45,-15.18,;35.97,-15.6,;35.58,-17.08,;34.8,-15.75,;34.26,-17.86,;32.92,-17.08,;32.92,-15.55,;31.59,-17.86,;31.59,-19.39,;30.25,-17.08,;28.93,-17.85,;28.93,-19.39,;27.59,-17.07,;26.26,-17.85,;24.94,-17.07,;24.94,-15.54,;23.61,-17.85,;23.61,-19.38,;24.94,-20.15,;26.26,-19.39,;27.59,-20.16,;27.59,-21.69,;26.26,-22.46,;24.93,-21.69,;22.28,-17.07,;20.94,-17.85,;20.94,-19.38,;19.6,-17.07,;19.6,-15.53,;20.94,-14.77,;22.28,-15.53,;20.94,-13.23,;18.27,-17.85,;16.89,-17.02,;16.91,-15.41,;15.48,-17.81,;14.09,-16.99,;12.7,-17.77,;11.31,-16.94,;11.32,-15.32,;12.74,-14.54,;14.13,-15.37,;13.17,-12.98,;14.73,-12.57,;12.03,-11.83,;9.93,-14.49,;8.53,-15.27,;8.51,-16.88,;7.08,-17.67,;5.7,-16.84,;4.27,-17.63,;5.73,-15.22,;7.14,-14.44,;7.15,-12.82,;8.58,-12.05,;8.6,-10.43,;10.02,-9.63,;10.03,-8,;11.4,-10.47,;11.37,-12.08,;9.96,-12.87,;27.59,-15.54,;26.26,-14.78,;28.93,-14.78,;36.91,-17.86,;36.91,-19.4,;38.24,-17.09,;39.58,-17.87,;39.58,-19.4,;40.9,-20.17,;42.23,-19.4,;40.9,-21.71,;40.9,-17.09,;40.9,-15.56,;42.24,-17.87,;43.57,-17.09,;43.57,-15.57,;44.9,-14.79,;44.9,-13.27,;46.23,-15.57,;44.9,-17.88,;44.9,-19.41,;46.23,-17.1,;47.56,-17.88,;47.56,-19.41,;48.89,-20.17,;48.89,-21.72,;47.56,-22.49,;50.22,-22.49,;48.89,-17.1,;48.89,-15.57,;50.23,-17.88,;68.86,-17.9,;70.18,-17.13,;68.86,-19.44,)| Show InChI InChI=1S/C99H119Cl2N17O24S/c1-49(2)37-69-86(129)108-68(33-34-80(124)125)91(134)118-99(9,96(141)113-72(42-56-48-104-67-24-18-17-23-60(56)67)87(130)111-71(41-55-25-32-65(100)66(101)39-55)85(128)105-51(5)83(126)112-75(94(138)139)38-50(3)4)36-20-13-11-10-12-19-35-98(8,95(140)114-73(46-78(102)122)88(131)109-69)117-84(127)52(6)106-92(135)82(53(7)119)116-90(133)70(40-54-21-15-14-16-22-54)110-89(132)74(47-79(103)123)115-97(143)107-57-26-29-61(64(43-57)93(136)137)81-62-30-27-58(120)44-76(62)142-77-45-59(121)28-31-63(77)81/h10-11,14-18,21-32,39,43-45,48-53,68-75,82,104,119-120H,12-13,19-20,33-38,40-42,46-47H2,1-9H3,(H2,102,122)(H2,103,123)(H,105,128)(H,106,135)(H,108,129)(H,109,131)(H,110,132)(H,111,130)(H,112,126)(H,113,141)(H,114,140)(H,116,133)(H,117,127)(H,118,134)(H,124,125)(H,136,137)(H,138,139)(H2,107,115,143)/b11-10-/t51-,52-,53+,68-,69-,70-,71-,72-,73-,74-,75-,82-,98+,99+/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 42 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006727
(CHEMBL3236546)Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC(C)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N1CCC[C@H]1C(N)=O |r| Show InChI InChI=1S/C83H118N18O29S/c1-8-41(4)67(98-78(125)56(36-65(112)113)94-76(123)55(35-64(110)111)95-79(126)60-21-15-30-101(60)83(130)58(39-102)97-74(121)52(32-40(2)3)91-73(120)51(28-31-131-7)87-43(6)104)80(127)89-49(23-26-62(106)107)70(117)88-48(22-25-61(84)105)71(118)93-54(34-45-38-86-47-19-13-12-18-46(45)47)75(122)92-53(33-44-16-10-9-11-17-44)77(124)99-68(42(5)103)81(128)90-50(24-27-63(108)109)72(119)96-57(37-66(114)115)82(129)100-29-14-20-59(100)69(85)116/h9-13,16-19,38,40-42,48-60,67-68,86,102-103H,8,14-15,20-37,39H2,1-7H3,(H2,84,105)(H2,85,116)(H,87,104)(H,88,117)(H,89,127)(H,90,128)(H,91,120)(H,92,122)(H,93,118)(H,94,123)(H,95,126)(H,96,119)(H,97,121)(H,98,125)(H,99,124)(H,106,107)(H,108,109)(H,110,111)(H,112,113)(H,114,115)/t41-,42+,48-,49-,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,67-,68-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.00E+5 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006728
(CHEMBL3236547)Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(=S)Nc1ccc(c(c1)C(O)=O)-c1c2ccc(O)cc2oc2cc(=O)ccc12)[C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(N)=O |r,wU:110.115,125.130,138.143,26.26,8.8,55.55,70.71,104.110,42.42,wD:118.122,119.125,17.17,4.3,50.50,59.59,34.34,133.138,(59,-22.02,;59,-20.48,;60.33,-19.72,;57.67,-19.72,;57.67,-18.17,;56.33,-17.41,;55,-18.17,;55,-19.72,;53.66,-17.41,;53.66,-15.87,;55,-15.1,;55,-13.56,;53.66,-12.79,;56.33,-12.79,;52.34,-18.17,;51,-17.41,;51,-15.87,;49.66,-18.17,;49.66,-19.72,;51,-20.48,;51,-22.02,;49.66,-22.8,;52.34,-22.8,;48.33,-17.41,;47,-18.17,;47,-19.72,;45.66,-17.41,;45.66,-15.87,;47,-15.1,;47,-13.56,;48.33,-15.87,;44.33,-18.17,;43,-17.41,;43,-15.87,;41.66,-18.17,;41.66,-19.72,;43,-20.48,;44.33,-19.72,;43,-22.02,;40.33,-17.41,;38.99,-18.17,;38.99,-19.72,;37.67,-17.41,;37.67,-15.87,;38.99,-15.1,;40.33,-15.87,;38.99,-13.56,;36.32,-18.17,;35,-17.41,;35,-15.87,;33.66,-18.17,;33.66,-19.72,;32.33,-17.41,;31,-18.17,;31,-19.72,;29.65,-17.41,;28.33,-18.17,;26.99,-17.41,;26.99,-15.87,;25.66,-18.17,;25.66,-19.72,;26.99,-20.48,;28.32,-19.72,;29.64,-20.48,;29.64,-22.02,;28.32,-22.8,;26.99,-22.02,;24.33,-17.41,;23,-18.17,;23,-19.72,;21.66,-17.41,;21.66,-15.87,;23,-15.1,;24.33,-15.87,;23,-13.56,;20.32,-18.17,;19,-17.39,;19.02,-15.85,;17.66,-18.14,;16.34,-17.36,;15,-18.1,;13.68,-17.31,;13.69,-15.77,;15.04,-15.02,;16.37,-15.81,;15.45,-13.53,;16.95,-13.14,;14.37,-12.44,;12.36,-14.97,;11.03,-15.72,;11.01,-17.26,;9.65,-18.01,;8.33,-17.22,;6.96,-17.96,;8.36,-15.67,;9.7,-14.92,;9.72,-13.38,;11.08,-12.65,;11.1,-11.1,;12.45,-10.34,;12.46,-8.78,;13.77,-11.14,;13.74,-12.68,;12.39,-13.43,;29.65,-15.87,;28.33,-15.1,;31,-15.1,;59,-17.41,;59,-15.87,;60.33,-18.17,;61.67,-17.41,;61.67,-15.87,;63,-15.1,;64.34,-15.87,;63,-13.56,;63,-18.17,;63,-19.72,;64.34,-17.41,;65.66,-18.17,;65.66,-19.72,;64.34,-20.48,;67,-20.48,;67,-17.41,;67,-15.87,;68.33,-18.17,;69.66,-17.41,;69.66,-15.87,;71,-15.1,;71,-13.56,;72.34,-15.87,;71,-18.17,;71,-19.72,;72.34,-17.41,;73.67,-18.17,;73.67,-19.72,;75,-17.41,;75,-15.87,;76.33,-18.17,;77.67,-17.41,;77.67,-15.87,;79,-15.1,;79,-18.17,;80.34,-17.41,;79,-19.72,)| Show InChI InChI=1S/C91H119N17O35S/c1-38(2)26-55(80(131)93-41(7)77(128)105-63(37-109)75(92)126)104-89(140)74(44(10)111)108-87(138)61(35-70(122)123)103-82(133)57(28-40(5)6)99-79(130)54(23-25-67(116)117)96-78(129)53(22-24-66(114)115)97-81(132)56(27-39(3)4)100-84(135)60(34-69(120)121)102-83(134)59(33-68(118)119)98-76(127)42(8)94-88(139)73(43(9)110)107-86(137)58(29-45-14-12-11-13-15-45)101-85(136)62(36-71(124)125)106-91(144)95-46-16-19-49(52(30-46)90(141)142)72-50-20-17-47(112)31-64(50)143-65-32-48(113)18-21-51(65)72/h11-21,30-32,38-44,53-63,73-74,109-112H,22-29,33-37H2,1-10H3,(H2,92,126)(H,93,131)(H,94,139)(H,96,129)(H,97,132)(H,98,127)(H,99,130)(H,100,135)(H,101,136)(H,102,134)(H,103,133)(H,104,140)(H,105,128)(H,107,137)(H,108,138)(H,114,115)(H,116,117)(H,118,119)(H,120,121)(H,122,123)(H,124,125)(H,141,142)(H2,95,106,144)/t41-,42-,43+,44+,53-,54-,55-,56-,57-,58-,59-,60-,61-,62-,63-,73-,74-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 6.40E+3 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006724
(CHEMBL3236543)Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@]1(C)CCC\C=C/CCC[C@@](C)(NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=S)Nc2ccc(c(c2)C(O)=O)-c2c3ccc(O)cc3oc3cc(=O)ccc23)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(O)=O)C(=O)N1)C(O)=O |r,wU:58.61,4.3,73.77,38.41,121.129,48.51,13.13,107.116,wD:113.121,24.25,53.56,8.8,129.137,62.65,c:46,(67.85,-15.26,;66.52,-14.5,;66.52,-12.97,;65.19,-15.26,;65.19,-16.8,;63.86,-17.57,;62.53,-16.8,;62.53,-15.27,;61.21,-17.56,;61.21,-19.11,;59.87,-16.79,;58.55,-17.56,;58.55,-19.1,;57.21,-16.79,;57.21,-15.26,;58.55,-14.49,;59.88,-15.27,;61.21,-14.5,;61.21,-12.97,;59.88,-12.19,;58.55,-12.96,;55.89,-17.56,;54.55,-16.79,;54.55,-15.26,;53.22,-17.55,;53.22,-19.1,;54.55,-19.85,;55.95,-19.24,;56.98,-20.37,;56.21,-21.71,;56.69,-23.17,;55.65,-24.31,;54.15,-24,;53.68,-22.53,;54.7,-21.39,;51.89,-16.78,;50.57,-17.55,;50.57,-19.09,;49.23,-16.78,;50.32,-15.68,;48.46,-15.44,;49.23,-14.11,;48.46,-12.78,;49.22,-11.45,;48.46,-10.12,;35.53,-13.38,;35.15,-14.86,;33.66,-15.26,;33.28,-16.76,;32.5,-15.42,;31.96,-17.53,;30.62,-16.75,;30.62,-15.23,;29.29,-17.53,;29.29,-19.06,;27.96,-16.75,;26.63,-17.53,;26.63,-19.06,;25.3,-16.75,;23.97,-17.52,;22.64,-16.74,;22.64,-15.22,;21.32,-17.52,;21.32,-19.05,;22.64,-19.82,;22.64,-21.36,;23.96,-22.13,;25.29,-21.36,;25.3,-19.83,;23.97,-19.06,;19.99,-16.74,;18.66,-17.52,;18.66,-19.05,;17.32,-16.74,;17.32,-15.21,;18.66,-14.45,;19.99,-15.21,;18.66,-12.91,;15.99,-17.52,;14.6,-16.69,;14.62,-15.08,;13.2,-17.48,;11.81,-16.66,;10.42,-17.44,;9.03,-16.61,;9.05,-14.99,;10.46,-14.21,;11.85,-15.04,;10.89,-12.66,;12.45,-12.25,;9.75,-11.51,;7.65,-14.16,;6.25,-14.95,;6.23,-16.55,;4.81,-17.34,;3.43,-16.52,;2,-17.3,;3.46,-14.9,;4.87,-14.11,;4.88,-12.5,;6.31,-11.73,;6.32,-10.11,;7.74,-9.31,;7.75,-7.68,;9.12,-10.15,;9.09,-11.76,;7.68,-12.55,;25.3,-15.22,;23.97,-14.46,;26.63,-14.46,;34.61,-17.54,;34.61,-19.07,;35.94,-16.76,;37.27,-17.54,;37.27,-19.07,;38.6,-19.83,;39.92,-19.07,;38.6,-21.38,;38.6,-16.76,;38.6,-15.24,;39.93,-17.54,;41.26,-16.77,;41.26,-15.24,;42.59,-14.47,;43.92,-15.24,;42.59,-12.94,;42.59,-17.55,;42.59,-19.08,;43.92,-16.77,;45.25,-17.55,;45.25,-19.08,;46.58,-19.84,;46.58,-21.39,;45.24,-22.16,;47.9,-22.15,;46.58,-16.77,;46.58,-15.25,;47.91,-17.55,;66.52,-17.57,;67.85,-16.8,;66.52,-19.11,)| Show InChI InChI=1S/C99H121N17O24S/c1-51(2)40-69-86(127)106-68(36-37-80(122)123)91(132)116-99(9,96(139)111-72(44-58-50-102-67-29-21-20-28-62(58)67)87(128)108-70(42-56-24-16-14-17-25-56)85(126)103-53(5)83(124)110-75(94(136)137)41-52(3)4)39-23-13-11-10-12-22-38-98(8,95(138)112-73(48-78(100)120)88(129)107-69)115-84(125)54(6)104-92(133)82(55(7)117)114-90(131)71(43-57-26-18-15-19-27-57)109-89(130)74(49-79(101)121)113-97(141)105-59-30-33-63(66(45-59)93(134)135)81-64-34-31-60(118)46-76(64)140-77-47-61(119)32-35-65(77)81/h10-11,14-21,24-35,45-47,50-55,68-75,82,102,117-118H,12-13,22-23,36-44,48-49H2,1-9H3,(H2,100,120)(H2,101,121)(H,103,126)(H,104,133)(H,106,127)(H,107,129)(H,108,128)(H,109,130)(H,110,124)(H,111,139)(H,112,138)(H,114,131)(H,115,125)(H,116,132)(H,122,123)(H,134,135)(H,136,137)(H2,105,113,141)/b11-10-/t53-,54-,55+,68-,69-,70-,71-,72-,73-,74-,75-,82-,98+,99+/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.20E+4 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 A/B region (181 to 422 amino acids) expressed in Escherichia coli Rosetta by fluorescence polarization an... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006726
(CHEMBL3236545)Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(Cl)c(Cl)c1)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@]1(C)CCC\C=C/CCC[C@@](C)(NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=S)Nc2ccc(c(c2)C(O)=O)-c2c3ccc(O)cc3oc3cc(=O)ccc23)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(O)=O)C(=O)N1)C(O)=O |r,wU:123.131,109.118,60.63,4.3,75.79,13.13,50.53,40.43,wD:115.123,131.139,64.67,55.58,26.27,8.8,c:48,(68.86,-13.3,;68.86,-14.83,;70.19,-15.6,;67.52,-15.6,;67.52,-17.13,;66.19,-17.9,;64.87,-17.12,;64.87,-15.59,;63.54,-17.89,;63.54,-19.44,;62.2,-17.12,;60.88,-17.89,;60.88,-19.43,;59.54,-17.12,;59.54,-15.59,;60.88,-14.82,;62.21,-15.59,;63.54,-14.82,;63.54,-13.29,;64.88,-12.53,;62.21,-12.51,;62.22,-10.97,;60.88,-13.29,;58.21,-17.88,;56.87,-17.11,;56.87,-15.58,;55.54,-17.88,;55.54,-19.42,;56.87,-20.19,;58.28,-19.57,;59.31,-20.71,;58.53,-22.04,;59.02,-23.51,;57.98,-24.65,;56.47,-24.33,;56.01,-22.86,;57.03,-21.72,;54.22,-17.11,;52.89,-17.88,;52.89,-19.42,;51.55,-17.11,;52.64,-16,;50.78,-15.76,;51.54,-14.43,;50.78,-13.1,;51.54,-11.77,;50.78,-10.44,;37.84,-13.7,;37.45,-15.18,;35.97,-15.6,;35.58,-17.08,;34.8,-15.75,;34.26,-17.86,;32.92,-17.08,;32.92,-15.55,;31.59,-17.86,;31.59,-19.39,;30.25,-17.08,;28.93,-17.85,;28.93,-19.39,;27.59,-17.07,;26.26,-17.85,;24.94,-17.07,;24.94,-15.54,;23.61,-17.85,;23.61,-19.38,;24.94,-20.15,;26.26,-19.39,;27.59,-20.16,;27.59,-21.69,;26.26,-22.46,;24.93,-21.69,;22.28,-17.07,;20.94,-17.85,;20.94,-19.38,;19.6,-17.07,;19.6,-15.53,;20.94,-14.77,;22.28,-15.53,;20.94,-13.23,;18.27,-17.85,;16.89,-17.02,;16.91,-15.41,;15.48,-17.81,;14.09,-16.99,;12.7,-17.77,;11.31,-16.94,;11.32,-15.32,;12.74,-14.54,;14.13,-15.37,;13.17,-12.98,;14.73,-12.57,;12.03,-11.83,;9.93,-14.49,;8.53,-15.27,;8.51,-16.88,;7.08,-17.67,;5.7,-16.84,;4.27,-17.63,;5.73,-15.22,;7.14,-14.44,;7.15,-12.82,;8.58,-12.05,;8.6,-10.43,;10.02,-9.63,;10.03,-8,;11.4,-10.47,;11.37,-12.08,;9.96,-12.87,;27.59,-15.54,;26.26,-14.78,;28.93,-14.78,;36.91,-17.86,;36.91,-19.4,;38.24,-17.09,;39.58,-17.87,;39.58,-19.4,;40.9,-20.17,;42.23,-19.4,;40.9,-21.71,;40.9,-17.09,;40.9,-15.56,;42.24,-17.87,;43.57,-17.09,;43.57,-15.57,;44.9,-14.79,;44.9,-13.27,;46.23,-15.57,;44.9,-17.88,;44.9,-19.41,;46.23,-17.1,;47.56,-17.88,;47.56,-19.41,;48.89,-20.17,;48.89,-21.72,;47.56,-22.49,;50.22,-22.49,;48.89,-17.1,;48.89,-15.57,;50.23,-17.88,;68.86,-17.9,;70.18,-17.13,;68.86,-19.44,)| Show InChI InChI=1S/C99H119Cl2N17O24S/c1-49(2)37-69-86(129)108-68(33-34-80(124)125)91(134)118-99(9,96(141)113-72(42-56-48-104-67-24-18-17-23-60(56)67)87(130)111-71(41-55-25-32-65(100)66(101)39-55)85(128)105-51(5)83(126)112-75(94(138)139)38-50(3)4)36-20-13-11-10-12-19-35-98(8,95(140)114-73(46-78(102)122)88(131)109-69)117-84(127)52(6)106-92(135)82(53(7)119)116-90(133)70(40-54-21-15-14-16-22-54)110-89(132)74(47-79(103)123)115-97(143)107-57-26-29-61(64(43-57)93(136)137)81-62-30-27-58(120)44-76(62)142-77-45-59(121)28-31-63(77)81/h10-11,14-18,21-32,39,43-45,48-53,68-75,82,104,119-120H,12-13,19-20,33-38,40-42,46-47H2,1-9H3,(H2,102,122)(H2,103,123)(H,105,128)(H,106,135)(H,108,129)(H,109,131)(H,110,132)(H,111,130)(H,112,126)(H,113,141)(H,114,140)(H,116,133)(H,117,127)(H,118,134)(H,124,125)(H,136,137)(H,138,139)(H2,107,115,143)/b11-10-/t51-,52-,53+,68-,69-,70-,71-,72-,73-,74-,75-,82-,98+,99+/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 2.40E+3 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 A/B region (181 to 422 amino acids) expressed in Escherichia coli Rosetta by fluorescence polarization an... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006729
(CHEMBL3236287)Show SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(C)=O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(N)=O |r| Show InChI InChI=1S/C72H110N16O31/c1-30(2)21-41(63(110)74-33(7)60(107)86-49(29-89)58(73)105)85-72(119)57(36(10)91)88-70(117)48(28-55(103)104)84-65(112)43(23-32(5)6)80-62(109)40(18-20-51(95)96)77-61(108)39(17-19-50(93)94)78-64(111)42(22-31(3)4)81-68(115)47(27-54(101)102)83-67(114)46(26-53(99)100)79-59(106)34(8)75-71(118)56(35(9)90)87-69(116)44(24-38-15-13-12-14-16-38)82-66(113)45(25-52(97)98)76-37(11)92/h12-16,30-36,39-49,56-57,89-91H,17-29H2,1-11H3,(H2,73,105)(H,74,110)(H,75,118)(H,76,92)(H,77,108)(H,78,111)(H,79,106)(H,80,109)(H,81,115)(H,82,113)(H,83,114)(H,84,112)(H,85,119)(H,86,107)(H,87,116)(H,88,117)(H,93,94)(H,95,96)(H,97,98)(H,99,100)(H,101,102)(H,103,104)/t33-,34-,35+,36+,39-,40-,41-,42-,43-,44-,45-,46-,47-,48-,49-,56-,57-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 2.90E+4 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006731
(CHEMBL3236286)Show SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(C)=O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(N)=O |r| Show InChI InChI=1S/C71H110N16O29/c1-30(2)22-42(63(108)74-34(8)60(105)85-49(29-88)57(72)102)84-71(116)56(37(11)90)87-69(114)48(28-54(100)101)83-65(110)44(24-32(5)6)80-62(107)41(19-21-51(94)95)76-61(106)40(18-20-50(92)93)77-64(109)43(23-31(3)4)81-67(112)47(27-53(98)99)82-66(111)46(26-52(96)97)79-59(104)35(9)75-70(115)55(36(10)89)86-68(113)45(25-39-16-14-13-15-17-39)78-58(103)33(7)73-38(12)91/h13-17,30-37,40-49,55-56,88-90H,18-29H2,1-12H3,(H2,72,102)(H,73,91)(H,74,108)(H,75,115)(H,76,106)(H,77,109)(H,78,103)(H,79,104)(H,80,107)(H,81,112)(H,82,111)(H,83,110)(H,84,116)(H,85,105)(H,86,113)(H,87,114)(H,92,93)(H,94,95)(H,96,97)(H,98,99)(H,100,101)/t33-,34-,35-,36+,37+,40-,41-,42-,43-,44-,45-,46-,47-,48-,49-,55-,56-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.52E+5 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006732
(CHEMBL3236285)Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(N)=O |r| Show InChI InChI=1S/C66H106N16O31/c1-25(2)17-36(58(105)68-28(7)54(101)80-43(24-83)52(67)99)79-66(113)51(32(11)85)82-64(111)42(23-49(97)98)78-61(108)38(19-27(5)6)75-57(104)35(14-16-45(89)90)72-56(103)34(13-15-44(87)88)73-60(107)37(18-26(3)4)76-63(110)41(22-48(95)96)77-62(109)40(21-47(93)94)74-53(100)29(8)70-65(112)50(31(10)84)81-55(102)30(9)69-59(106)39(20-46(91)92)71-33(12)86/h25-32,34-43,50-51,83-85H,13-24H2,1-12H3,(H2,67,99)(H,68,105)(H,69,106)(H,70,112)(H,71,86)(H,72,103)(H,73,107)(H,74,100)(H,75,104)(H,76,110)(H,77,109)(H,78,108)(H,79,113)(H,80,101)(H,81,102)(H,82,111)(H,87,88)(H,89,90)(H,91,92)(H,93,94)(H,95,96)(H,97,98)/t28-,29-,30-,31+,32+,34-,35-,36-,37-,38-,39-,40-,41-,42-,43-,50-,51-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | >1.00E+6 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006733
(CHEMBL3236284)Show SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(N)=O |r| Show InChI InChI=1S/C71H108N16O30/c1-30(2)21-41(63(109)75-35(9)60(106)86-49(29-88)57(72)103)85-71(117)56(36(10)89)87-70(116)48(28-55(101)102)84-66(112)43(23-32(5)6)80-62(108)40(18-20-51(93)94)77-61(107)39(17-19-50(91)92)78-65(111)42(22-31(3)4)81-69(115)47(27-54(99)100)83-68(114)46(26-53(97)98)79-59(105)34(8)73-58(104)33(7)74-64(110)44(24-38-15-13-12-14-16-38)82-67(113)45(25-52(95)96)76-37(11)90/h12-16,30-36,39-49,56,88-89H,17-29H2,1-11H3,(H2,72,103)(H,73,104)(H,74,110)(H,75,109)(H,76,90)(H,77,107)(H,78,111)(H,79,105)(H,80,108)(H,81,115)(H,82,113)(H,83,114)(H,84,112)(H,85,117)(H,86,106)(H,87,116)(H,91,92)(H,93,94)(H,95,96)(H,97,98)(H,99,100)(H,101,102)/t33-,34-,35-,36+,39-,40-,41-,42-,43-,44-,45-,46-,47-,48-,49-,56-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.52E+5 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006734
(CHEMBL3236283)Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(N)=O |r| Show InChI InChI=1S/C71H110N16O29/c1-30(2)22-42(63(108)74-35(9)60(105)85-49(29-88)57(72)102)84-71(116)56(37(11)90)87-69(114)48(28-54(100)101)83-65(110)44(24-32(5)6)80-62(107)41(19-21-51(94)95)77-61(106)40(18-20-50(92)93)78-64(109)43(23-31(3)4)81-67(112)47(27-53(98)99)79-59(104)34(8)73-58(103)33(7)75-70(115)55(36(10)89)86-68(113)45(25-39-16-14-13-15-17-39)82-66(111)46(26-52(96)97)76-38(12)91/h13-17,30-37,40-49,55-56,88-90H,18-29H2,1-12H3,(H2,72,102)(H,73,103)(H,74,108)(H,75,115)(H,76,91)(H,77,106)(H,78,109)(H,79,104)(H,80,107)(H,81,112)(H,82,111)(H,83,110)(H,84,116)(H,85,105)(H,86,113)(H,87,114)(H,92,93)(H,94,95)(H,96,97)(H,98,99)(H,100,101)/t33-,34-,35-,36+,37+,40-,41-,42-,43-,44-,45-,46-,47-,48-,49-,55-,56-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 3.10E+4 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006735
(CHEMBL3236282)Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(N)=O |r| Show InChI InChI=1S/C71H110N16O29/c1-30(2)22-42(63(108)73-34(8)60(105)85-49(29-88)57(72)102)84-71(116)56(37(11)90)87-69(114)48(28-54(100)101)83-66(111)44(24-32(5)6)81-62(107)41(19-21-51(94)95)77-61(106)40(18-20-50(92)93)78-65(110)43(23-31(3)4)79-58(103)33(7)74-64(109)47(27-53(98)99)80-59(104)35(9)75-70(115)55(36(10)89)86-68(113)45(25-39-16-14-13-15-17-39)82-67(112)46(26-52(96)97)76-38(12)91/h13-17,30-37,40-49,55-56,88-90H,18-29H2,1-12H3,(H2,72,102)(H,73,108)(H,74,109)(H,75,115)(H,76,91)(H,77,106)(H,78,110)(H,79,103)(H,80,104)(H,81,107)(H,82,112)(H,83,111)(H,84,116)(H,85,105)(H,86,113)(H,87,114)(H,92,93)(H,94,95)(H,96,97)(H,98,99)(H,100,101)/t33-,34-,35-,36+,37+,40-,41-,42-,43-,44-,45-,46-,47-,48-,49-,55-,56-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 2.25E+5 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006736
(CHEMBL3236281)Show SMILES CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(C)=O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(N)=O |r| Show InChI InChI=1S/C69H104N16O31/c1-28(2)20-39(61(108)71-31(6)58(105)83-46(27-86)55(70)102)82-69(116)54(34(9)88)85-67(114)45(26-52(100)101)81-63(110)40(21-29(3)4)78-60(107)38(17-19-48(92)93)76-59(106)37(16-18-47(90)91)75-56(103)30(5)72-62(109)43(24-50(96)97)80-65(112)44(25-51(98)99)77-57(104)32(7)73-68(115)53(33(8)87)84-66(113)41(22-36-14-12-11-13-15-36)79-64(111)42(23-49(94)95)74-35(10)89/h11-15,28-34,37-46,53-54,86-88H,16-27H2,1-10H3,(H2,70,102)(H,71,108)(H,72,109)(H,73,115)(H,74,89)(H,75,103)(H,76,106)(H,77,104)(H,78,107)(H,79,111)(H,80,112)(H,81,110)(H,82,116)(H,83,105)(H,84,113)(H,85,114)(H,90,91)(H,92,93)(H,94,95)(H,96,97)(H,98,99)(H,100,101)/t30-,31-,32-,33+,34+,37-,38-,39-,40-,41-,42-,43-,44-,45-,46-,53-,54-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.72E+5 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006737
(CHEMBL3236280)Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(O)=O |r| Show InChI InChI=1S/C70H107N15O30/c1-29(2)20-40(78-65(109)46(26-52(96)97)80-64(108)45(25-51(94)95)76-57(101)34(9)73-68(112)54(35(10)87)84-66(110)43(23-38-16-14-13-15-17-38)79-63(107)44(24-50(92)93)74-37(12)89)60(104)71-32(7)56(100)75-39(18-19-49(90)91)59(103)77-42(22-31(5)6)62(106)81-47(27-53(98)99)67(111)85-55(36(11)88)69(113)82-41(21-30(3)4)61(105)72-33(8)58(102)83-48(28-86)70(114)115/h13-17,29-36,39-48,54-55,86-88H,18-28H2,1-12H3,(H,71,104)(H,72,105)(H,73,112)(H,74,89)(H,75,100)(H,76,101)(H,77,103)(H,78,109)(H,79,107)(H,80,108)(H,81,106)(H,82,113)(H,83,102)(H,84,110)(H,85,111)(H,90,91)(H,92,93)(H,94,95)(H,96,97)(H,98,99)(H,114,115)/t32-,33-,34-,35+,36+,39-,40-,41-,42-,43-,44-,45-,46-,47-,48-,54-,55-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 2.20E+4 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50006738
(CHEMBL3236279)Show SMILES CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(O)=O)NC(C)=O)[C@@H](C)O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CO)C(N)=O |r| Show InChI InChI=1S/C70H108N16O29/c1-29(2)20-40(61(106)73-33(8)59(104)84-48(28-87)56(71)101)83-70(115)55(36(11)89)86-68(113)47(27-53(99)100)82-63(108)41(21-30(3)4)77-57(102)32(7)72-60(105)39(18-19-49(91)92)76-62(107)42(22-31(5)6)79-66(111)46(26-52(97)98)81-65(110)45(25-51(95)96)78-58(103)34(9)74-69(114)54(35(10)88)85-67(112)43(23-38-16-14-13-15-17-38)80-64(109)44(24-50(93)94)75-37(12)90/h13-17,29-36,39-48,54-55,87-89H,18-28H2,1-12H3,(H2,71,101)(H,72,105)(H,73,106)(H,74,114)(H,75,90)(H,76,107)(H,77,102)(H,78,103)(H,79,111)(H,80,109)(H,81,110)(H,82,108)(H,83,115)(H,84,104)(H,85,112)(H,86,113)(H,91,92)(H,93,94)(H,95,96)(H,97,98)(H,99,100)/t32-,33-,34-,35+,36+,39-,40-,41-,42-,43-,44-,45-,46-,47-,48-,54-,55-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 1.67E+5 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to recombinant human RPA70 N-terminal domain (1 to 120 amino acids) expressed in Escherichia coli BL21-DE3 by fluorescence polarizat... |
J Med Chem 57: 2455-61 (2014)
Article DOI: 10.1021/jm401730y
BindingDB Entry DOI: 10.7270/Q29888H7 |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50080584
(CHEMBL3421641)Show SMILES OC(=O)c1cc(-c2ccc(CNC(=O)c3ccccc3)cc2)n(n1)-c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C24H17Cl2N3O3/c25-19-11-10-18(12-20(19)26)29-22(13-21(28-29)24(31)32)16-8-6-15(7-9-16)14-27-23(30)17-4-2-1-3-5-17/h1-13H,14H2,(H,27,30)(H,31,32) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 90 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to RPA70N protein (unknown origin) incubated for 1 hr using FITC-ATRIP/FITC-ATRIP2 peptide probe by fluorescence polarization anisot... |
ACS Med Chem Lett 6: 140-5 (2015)
Article DOI: 10.1021/ml5003629
BindingDB Entry DOI: 10.7270/Q2HM5B5R |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50080673
(CHEMBL3422456)Show SMILES COc1ccc(CNC(=O)c2ccc(cc2)-c2cc(nn2-c2ccc(Cl)c(Cl)c2)C(O)=O)cc1 Show InChI InChI=1S/C25H19Cl2N3O4/c1-34-19-9-2-15(3-10-19)14-28-24(31)17-6-4-16(5-7-17)23-13-22(25(32)33)29-30(23)18-8-11-20(26)21(27)12-18/h2-13H,14H2,1H3,(H,28,31)(H,32,33) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 45 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to RPA70N protein (unknown origin) incubated for 1 hr using FITC-ATRIP/FITC-ATRIP2 peptide probe by fluorescence polarization anisot... |
ACS Med Chem Lett 6: 140-5 (2015)
Article DOI: 10.1021/ml5003629
BindingDB Entry DOI: 10.7270/Q2HM5B5R |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50080674
(CHEMBL3422455)Show SMILES OC(=O)c1cc(-c2ccc(cc2)C(=O)NCc2ccccc2)n(n1)-c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C24H17Cl2N3O3/c25-19-11-10-18(12-20(19)26)29-22(13-21(28-29)24(31)32)16-6-8-17(9-7-16)23(30)27-14-15-4-2-1-3-5-15/h1-13H,14H2,(H,27,30)(H,31,32) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 83 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to RPA70N protein (unknown origin) incubated for 1 hr using FITC-ATRIP/FITC-ATRIP2 peptide probe by fluorescence polarization anisot... |
ACS Med Chem Lett 6: 140-5 (2015)
Article DOI: 10.1021/ml5003629
BindingDB Entry DOI: 10.7270/Q2HM5B5R |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50080693
(CHEMBL3422454)Show SMILES OC(=O)c1cc(Cc2ccc(O)cc2)n(n1)-c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C17H12Cl2N2O3/c18-14-6-3-11(8-15(14)19)21-12(9-16(20-21)17(23)24)7-10-1-4-13(22)5-2-10/h1-6,8-9,22H,7H2,(H,23,24) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | >500 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to RPA70N protein (unknown origin) incubated for 1 hr using FITC-ATRIP/FITC-ATRIP2 peptide probe by fluorescence polarization anisot... |
ACS Med Chem Lett 6: 140-5 (2015)
Article DOI: 10.1021/ml5003629
BindingDB Entry DOI: 10.7270/Q2HM5B5R |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50080767
(CHEMBL3422453)Show InChI InChI=1S/C14H8Cl2N2O3/c15-9-4-3-8(6-10(9)16)18-12(13-2-1-5-21-13)7-11(17-18)14(19)20/h1-7H,(H,19,20) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | >500 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to RPA70N protein (unknown origin) incubated for 1 hr using FITC-ATRIP/FITC-ATRIP2 peptide probe by fluorescence polarization anisot... |
ACS Med Chem Lett 6: 140-5 (2015)
Article DOI: 10.1021/ml5003629
BindingDB Entry DOI: 10.7270/Q2HM5B5R |
More data for this
Ligand-Target Pair | |
Replication protein A 70 kDa DNA-binding subunit
(Homo sapiens (Human)) | BDBM50080768
(CHEMBL3422452)Show SMILES OC(=O)c1cc(-c2ccc(O)cc2)n(n1)-c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C16H10Cl2N2O3/c17-12-6-3-10(7-13(12)18)20-15(8-14(19-20)16(22)23)9-1-4-11(21)5-2-9/h1-8,21H,(H,22,23) | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | 104 | n/a | n/a | n/a | n/a | n/a |
Vanderbilt University School of Medicine
Curated by ChEMBL
| Assay Description
Binding affinity to RPA70N protein (unknown origin) incubated for 1 hr using FITC-ATRIP/FITC-ATRIP2 peptide probe by fluorescence polarization anisot... |
ACS Med Chem Lett 6: 140-5 (2015)
Article DOI: 10.1021/ml5003629
BindingDB Entry DOI: 10.7270/Q2HM5B5R |
More data for this
Ligand-Target Pair | |
Search and Browse
