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Compile Data Set for Download or QSAR

Found 22 hits of kd data for polymerid = 50007836   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
DNA repair protein REV1


(Homo sapiens)
BDBM50463119
PNG
(CHEMBL4240676)
Show SMILES CC(C(C)=O)n1c(CN2CCN(CC2)c2cccc(Cl)c2)nc2n(C)c(=O)n(C)c(=O)c12
Show InChI InChI=1S/C22H27ClN6O3/c1-14(15(2)30)29-18(24-20-19(29)21(31)26(4)22(32)25(20)3)13-27-8-10-28(11-9-27)17-7-5-6-16(23)12-17/h5-7,12,14H,8-11,13H2,1-4H3
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n/an/an/a 2.10E+3n/an/an/an/an/a



University of Connecticut

Curated by ChEMBL


Assay Description
Displacement of FAM-labelled polkappa-RIR peptide from recombinant human C-terminal Rev1 (1158 to 1251 residues) expressed in Escherichia coli BL21(D...


Bioorg Med Chem 26: 4301-4309 (2018)


Article DOI: 10.1016/j.bmc.2018.07.029
BindingDB Entry DOI: 10.7270/Q2K93B5H
More data for this
Ligand-Target Pair
DNA repair protein REV1


(Homo sapiens)
BDBM50463115
PNG
(CHEMBL1717725)
Show SMILES Cc1ccc(cc1S(=O)(=O)N1CCOCC1)C(=O)N1CCN(CC1)c1ccccc1
Show InChI InChI=1S/C22H27N3O4S/c1-18-7-8-19(17-21(18)30(27,28)25-13-15-29-16-14-25)22(26)24-11-9-23(10-12-24)20-5-3-2-4-6-20/h2-8,17H,9-16H2,1H3
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n/an/an/a 2.90E+3n/an/an/an/an/a



University of Connecticut

Curated by ChEMBL


Assay Description
Displacement of FAM-labelled polkappa-RIR peptide from recombinant human C-terminal Rev1 (1158 to 1251 residues) expressed in Escherichia coli BL21(D...


Bioorg Med Chem 26: 4301-4309 (2018)


Article DOI: 10.1016/j.bmc.2018.07.029
BindingDB Entry DOI: 10.7270/Q2K93B5H
More data for this
Ligand-Target Pair
DNA repair protein REV1


(Homo sapiens)
BDBM50463107
PNG
(CHEMBL4245882)
Show SMILES CCCc1cc(C(=O)OC)c(NC(=O)C2CCN(CC2)C(C)=O)s1
Show InChI InChI=1S/C17H24N2O4S/c1-4-5-13-10-14(17(22)23-3)16(24-13)18-15(21)12-6-8-19(9-7-12)11(2)20/h10,12H,4-9H2,1-3H3,(H,18,21)
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n/an/an/a 3.50E+3n/an/an/an/an/a



University of Connecticut

Curated by ChEMBL


Assay Description
Displacement of FAM-labelled polkappa-RIR peptide from recombinant human C-terminal Rev1 (1158 to 1251 residues) expressed in Escherichia coli BL21(D...


Bioorg Med Chem 26: 4301-4309 (2018)


Article DOI: 10.1016/j.bmc.2018.07.029
BindingDB Entry DOI: 10.7270/Q2K93B5H
More data for this
Ligand-Target Pair
DNA repair protein REV1


(Homo sapiens)
BDBM50463120
PNG
(CHEMBL1721787)
Show SMILES CCc1ccc(NC(=O)CN2CCN(CC2)c2ccc(OC)cc2)cc1
Show InChI InChI=1S/C21H27N3O2/c1-3-17-4-6-18(7-5-17)22-21(25)16-23-12-14-24(15-13-23)19-8-10-20(26-2)11-9-19/h4-11H,3,12-16H2,1-2H3,(H,22,25)
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n/an/an/a 3.60E+3n/an/an/an/an/a



University of Connecticut

Curated by ChEMBL


Assay Description
Displacement of FAM-labelled polkappa-RIR peptide from recombinant human C-terminal Rev1 (1158 to 1251 residues) expressed in Escherichia coli BL21(D...


Bioorg Med Chem 26: 4301-4309 (2018)


Article DOI: 10.1016/j.bmc.2018.07.029
BindingDB Entry DOI: 10.7270/Q2K93B5H
More data for this
Ligand-Target Pair
DNA repair protein REV1


(Homo sapiens)
BDBM50463118
PNG
(CHEMBL4246571)
Show SMILES CCCCc1ccc(cc1)-n1nnc(C(=O)N(C)C2CCS(=O)(=O)C2)c1C
Show InChI InChI=1S/C19H26N4O3S/c1-4-5-6-15-7-9-16(10-8-15)23-14(2)18(20-21-23)19(24)22(3)17-11-12-27(25,26)13-17/h7-10,17H,4-6,11-13H2,1-3H3
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n/an/an/a 3.60E+3n/an/an/an/an/a



University of Connecticut

Curated by ChEMBL


Assay Description
Displacement of FAM-labelled polkappa-RIR peptide from recombinant human C-terminal Rev1 (1158 to 1251 residues) expressed in Escherichia coli BL21(D...


Bioorg Med Chem 26: 4301-4309 (2018)


Article DOI: 10.1016/j.bmc.2018.07.029
BindingDB Entry DOI: 10.7270/Q2K93B5H
More data for this
Ligand-Target Pair
DNA repair protein REV1


(Homo sapiens)
BDBM50463122
PNG
(CHEMBL4249812)
Show SMILES COc1ccc(OC)c(c1)-c1csc(n1)N1CCN(CC1)C(=O)c1ccco1
Show InChI InChI=1S/C20H21N3O4S/c1-25-14-5-6-17(26-2)15(12-14)16-13-28-20(21-16)23-9-7-22(8-10-23)19(24)18-4-3-11-27-18/h3-6,11-13H,7-10H2,1-2H3
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n/an/an/a 3.70E+3n/an/an/an/an/a



University of Connecticut

Curated by ChEMBL


Assay Description
Displacement of FAM-labelled polkappa-RIR peptide from recombinant human C-terminal Rev1 (1158 to 1251 residues) expressed in Escherichia coli BL21(D...


Bioorg Med Chem 26: 4301-4309 (2018)


Article DOI: 10.1016/j.bmc.2018.07.029
BindingDB Entry DOI: 10.7270/Q2K93B5H
More data for this
Ligand-Target Pair
DNA repair protein REV1


(Homo sapiens)
BDBM50463116
PNG
(CHEMBL4237457)
Show SMILES CCS(=O)(=O)N(C)c1ccc(cc1)C(=O)N1CCN(CC1)c1ccccc1OC
Show InChI InChI=1S/C21H27N3O4S/c1-4-29(26,27)22(2)18-11-9-17(10-12-18)21(25)24-15-13-23(14-16-24)19-7-5-6-8-20(19)28-3/h5-12H,4,13-16H2,1-3H3
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n/an/an/a 4.30E+3n/an/an/an/an/a



University of Connecticut

Curated by ChEMBL


Assay Description
Displacement of FAM-labelled polkappa-RIR peptide from recombinant human C-terminal Rev1 (1158 to 1251 residues) expressed in Escherichia coli BL21(D...


Bioorg Med Chem 26: 4301-4309 (2018)


Article DOI: 10.1016/j.bmc.2018.07.029
BindingDB Entry DOI: 10.7270/Q2K93B5H
More data for this
Ligand-Target Pair
DNA repair protein REV1


(Homo sapiens)
BDBM50463117
PNG
(CHEMBL4249624)
Show SMILES CC1CCc2c(C1)sc(NC(=O)C1CCN(CC1)C(C)=O)c2C(=O)NC1CC1
Show InChI InChI=1S/C21H29N3O3S/c1-12-3-6-16-17(11-12)28-21(18(16)20(27)22-15-4-5-15)23-19(26)14-7-9-24(10-8-14)13(2)25/h12,14-15H,3-11H2,1-2H3,(H,22,27)(H,23,26)
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n/an/an/a 4.40E+3n/an/an/an/an/a



University of Connecticut

Curated by ChEMBL


Assay Description
Displacement of FAM-labelled polkappa-RIR peptide from recombinant human C-terminal Rev1 (1158 to 1251 residues) expressed in Escherichia coli BL21(D...


Bioorg Med Chem 26: 4301-4309 (2018)


Article DOI: 10.1016/j.bmc.2018.07.029
BindingDB Entry DOI: 10.7270/Q2K93B5H
More data for this
Ligand-Target Pair
DNA repair protein REV1


(Homo sapiens)
BDBM50463106
PNG
(CHEMBL4238011)
Show SMILES CCc1ccc(NC(=O)CN2CCN(CC2)c2ccc(F)cc2)cc1
Show InChI InChI=1S/C20H24FN3O/c1-2-16-3-7-18(8-4-16)22-20(25)15-23-11-13-24(14-12-23)19-9-5-17(21)6-10-19/h3-10H,2,11-15H2,1H3,(H,22,25)
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n/an/an/a 6.50E+3n/an/an/an/an/a



University of Connecticut

Curated by ChEMBL


Assay Description
Displacement of FAM-labelled polkappa-RIR peptide from recombinant human C-terminal Rev1 (1158 to 1251 residues) expressed in Escherichia coli BL21(D...


Bioorg Med Chem 26: 4301-4309 (2018)


Article DOI: 10.1016/j.bmc.2018.07.029
BindingDB Entry DOI: 10.7270/Q2K93B5H
More data for this
Ligand-Target Pair
DNA repair protein REV1


(Homo sapiens)
BDBM50463108
PNG
(CHEMBL4244874)
Show SMILES CCn1c2ccccc2c2cc(NC(=O)N3CCC(CC3)C(C)=O)ccc12
Show InChI InChI=1S/C22H25N3O2/c1-3-25-20-7-5-4-6-18(20)19-14-17(8-9-21(19)25)23-22(27)24-12-10-16(11-13-24)15(2)26/h4-9,14,16H,3,10-13H2,1-2H3,(H,23,27)
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n/an/an/a 6.90E+3n/an/an/an/an/a



University of Connecticut

Curated by ChEMBL


Assay Description
Displacement of FAM-labelled polkappa-RIR peptide from recombinant human C-terminal Rev1 (1158 to 1251 residues) expressed in Escherichia coli BL21(D...


Bioorg Med Chem 26: 4301-4309 (2018)


Article DOI: 10.1016/j.bmc.2018.07.029
BindingDB Entry DOI: 10.7270/Q2K93B5H
More data for this
Ligand-Target Pair
DNA repair protein REV1


(Homo sapiens)
BDBM50463113
PNG
(CHEMBL4238016)
Show SMILES CCCc1cc(C(=O)OCC)c(NC(=O)C2CCN(CC2)C(C)=O)s1
Show InChI InChI=1S/C18H26N2O4S/c1-4-6-14-11-15(18(23)24-5-2)17(25-14)19-16(22)13-7-9-20(10-8-13)12(3)21/h11,13H,4-10H2,1-3H3,(H,19,22)
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n/an/an/a 7.80E+3n/an/an/an/an/a



University of Connecticut

Curated by ChEMBL


Assay Description
Displacement of FAM-labelled polkappa-RIR peptide from recombinant human C-terminal Rev1 (1158 to 1251 residues) expressed in Escherichia coli BL21(D...


Bioorg Med Chem 26: 4301-4309 (2018)


Article DOI: 10.1016/j.bmc.2018.07.029
BindingDB Entry DOI: 10.7270/Q2K93B5H
More data for this
Ligand-Target Pair
DNA repair protein REV1


(Homo sapiens)
BDBM50463105
PNG
(CHEMBL4244254)
Show SMILES COC(=O)c1cc(C)sc1NC(=O)C1CCN(CC1)C(C)=O
Show InChI InChI=1S/C15H20N2O4S/c1-9-8-12(15(20)21-3)14(22-9)16-13(19)11-4-6-17(7-5-11)10(2)18/h8,11H,4-7H2,1-3H3,(H,16,19)
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n/an/an/a 8.20E+3n/an/an/an/an/a



University of Connecticut

Curated by ChEMBL


Assay Description
Displacement of FAM-labelled polkappa-RIR peptide from recombinant human C-terminal Rev1 (1158 to 1251 residues) expressed in Escherichia coli BL21(D...


Bioorg Med Chem 26: 4301-4309 (2018)


Article DOI: 10.1016/j.bmc.2018.07.029
BindingDB Entry DOI: 10.7270/Q2K93B5H
More data for this
Ligand-Target Pair
DNA repair protein REV1


(Homo sapiens)
BDBM50463114
PNG
(CHEMBL4241371)
Show SMILES CCCC1CCc2c(C1)sc(NC(=O)C1CCN(CC1)C(C)=O)c2C(N)=O
Show InChI InChI=1S/C20H29N3O3S/c1-3-4-13-5-6-15-16(11-13)27-20(17(15)18(21)25)22-19(26)14-7-9-23(10-8-14)12(2)24/h13-14H,3-11H2,1-2H3,(H2,21,25)(H,22,26)
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n/an/an/a 9.50E+3n/an/an/an/an/a



University of Connecticut

Curated by ChEMBL


Assay Description
Displacement of FAM-labelled polkappa-RIR peptide from recombinant human C-terminal Rev1 (1158 to 1251 residues) expressed in Escherichia coli BL21(D...


Bioorg Med Chem 26: 4301-4309 (2018)


Article DOI: 10.1016/j.bmc.2018.07.029
BindingDB Entry DOI: 10.7270/Q2K93B5H
More data for this
Ligand-Target Pair
DNA repair protein REV1


(Homo sapiens)
BDBM50463123
PNG
(CHEMBL4239688)
Show SMILES Cc1cccc(N2CCN(CC(=O)Nc3ccc(F)cc3)CC2)c1C
Show InChI InChI=1S/C20H24FN3O/c1-15-4-3-5-19(16(15)2)24-12-10-23(11-13-24)14-20(25)22-18-8-6-17(21)7-9-18/h3-9H,10-14H2,1-2H3,(H,22,25)
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n/an/an/a 1.24E+4n/an/an/an/an/a



University of Connecticut

Curated by ChEMBL


Assay Description
Displacement of FAM-labelled polkappa-RIR peptide from recombinant human C-terminal Rev1 (1158 to 1251 residues) expressed in Escherichia coli BL21(D...


Bioorg Med Chem 26: 4301-4309 (2018)


Article DOI: 10.1016/j.bmc.2018.07.029
BindingDB Entry DOI: 10.7270/Q2K93B5H
More data for this
Ligand-Target Pair
DNA repair protein REV1


(Homo sapiens)
BDBM50463111
PNG
(CHEMBL4239342)
Show SMILES CC1CCc2c(C1)sc(NC(=O)C1CCN(CC1)C(C)=O)c2C(N)=O
Show InChI InChI=1S/C18H25N3O3S/c1-10-3-4-13-14(9-10)25-18(15(13)16(19)23)20-17(24)12-5-7-21(8-6-12)11(2)22/h10,12H,3-9H2,1-2H3,(H2,19,23)(H,20,24)
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n/an/an/a 1.26E+4n/an/an/an/an/a



University of Connecticut

Curated by ChEMBL


Assay Description
Displacement of FAM-labelled polkappa-RIR peptide from recombinant human C-terminal Rev1 (1158 to 1251 residues) expressed in Escherichia coli BL21(D...


Bioorg Med Chem 26: 4301-4309 (2018)


Article DOI: 10.1016/j.bmc.2018.07.029
BindingDB Entry DOI: 10.7270/Q2K93B5H
More data for this
Ligand-Target Pair
DNA repair protein REV1


(Homo sapiens)
BDBM50463103
PNG
(CHEMBL4237396)
Show SMILES COc1cc2CCN(Cc3ccc(OCc4ccccc4)cc3)Cc2cc1OC
Show InChI InChI=1S/C25H27NO3/c1-27-24-14-21-12-13-26(17-22(21)15-25(24)28-2)16-19-8-10-23(11-9-19)29-18-20-6-4-3-5-7-20/h3-11,14-15H,12-13,16-18H2,1-2H3
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n/an/an/a 1.26E+4n/an/an/an/an/a



University of Connecticut

Curated by ChEMBL


Assay Description
Displacement of FAM-labelled polkappa-RIR peptide from recombinant human C-terminal Rev1 (1158 to 1251 residues) expressed in Escherichia coli BL21(D...


Bioorg Med Chem 26: 4301-4309 (2018)


Article DOI: 10.1016/j.bmc.2018.07.029
BindingDB Entry DOI: 10.7270/Q2K93B5H
More data for this
Ligand-Target Pair
DNA repair protein REV1


(Homo sapiens)
BDBM50463109
PNG
(CHEMBL4241418)
Show SMILES CC(C)(C)C(=O)N1CCN(CC1)c1ccc(NC(=O)c2cccnc2)cc1Cl
Show InChI InChI=1S/C21H25ClN4O2/c1-21(2,3)20(28)26-11-9-25(10-12-26)18-7-6-16(13-17(18)22)24-19(27)15-5-4-8-23-14-15/h4-8,13-14H,9-12H2,1-3H3,(H,24,27)
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n/an/an/a 1.82E+4n/an/an/an/an/a



University of Connecticut

Curated by ChEMBL


Assay Description
Displacement of FAM-labelled polkappa-RIR peptide from recombinant human C-terminal Rev1 (1158 to 1251 residues) expressed in Escherichia coli BL21(D...


Bioorg Med Chem 26: 4301-4309 (2018)


Article DOI: 10.1016/j.bmc.2018.07.029
BindingDB Entry DOI: 10.7270/Q2K93B5H
More data for this
Ligand-Target Pair
DNA repair protein REV1


(Homo sapiens)
BDBM50463112
PNG
(CHEMBL4249428)
Show SMILES CCc1cc(C(=O)OC)c(NC(=O)C2CCN(CC2)C(C)=O)s1
Show InChI InChI=1S/C16H22N2O4S/c1-4-12-9-13(16(21)22-3)15(23-12)17-14(20)11-5-7-18(8-6-11)10(2)19/h9,11H,4-8H2,1-3H3,(H,17,20)
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n/an/an/a 2.37E+4n/an/an/an/an/a



University of Connecticut

Curated by ChEMBL


Assay Description
Displacement of FAM-labelled polkappa-RIR peptide from recombinant human C-terminal Rev1 (1158 to 1251 residues) expressed in Escherichia coli BL21(D...


Bioorg Med Chem 26: 4301-4309 (2018)


Article DOI: 10.1016/j.bmc.2018.07.029
BindingDB Entry DOI: 10.7270/Q2K93B5H
More data for this
Ligand-Target Pair
DNA repair protein REV1


(Homo sapiens)
BDBM50463104
PNG
(CHEMBL4242335)
Show SMILES CC(=O)N1CCC(CC1)C(=O)Nc1sc2CCCCc2c1C(=O)NC1CC1
Show InChI InChI=1S/C20H27N3O3S/c1-12(24)23-10-8-13(9-11-23)18(25)22-20-17(19(26)21-14-6-7-14)15-4-2-3-5-16(15)27-20/h13-14H,2-11H2,1H3,(H,21,26)(H,22,25)
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n/an/an/a 2.66E+4n/an/an/an/an/a



University of Connecticut

Curated by ChEMBL


Assay Description
Displacement of FAM-labelled polkappa-RIR peptide from recombinant human C-terminal Rev1 (1158 to 1251 residues) expressed in Escherichia coli BL21(D...


Bioorg Med Chem 26: 4301-4309 (2018)


Article DOI: 10.1016/j.bmc.2018.07.029
BindingDB Entry DOI: 10.7270/Q2K93B5H
More data for this
Ligand-Target Pair
DNA repair protein REV1


(Homo sapiens)
BDBM50463110
PNG
(CHEMBL2136004)
Show SMILES Fc1ccc(cc1)N1CCN(CC(=O)Nc2ccccc2)CC1
Show InChI InChI=1S/C18H20FN3O/c19-15-6-8-17(9-7-15)22-12-10-21(11-13-22)14-18(23)20-16-4-2-1-3-5-16/h1-9H,10-14H2,(H,20,23)
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n/an/an/a 4.22E+4n/an/an/an/an/a



University of Connecticut

Curated by ChEMBL


Assay Description
Displacement of FAM-labelled polkappa-RIR peptide from recombinant human C-terminal Rev1 (1158 to 1251 residues) expressed in Escherichia coli BL21(D...


Bioorg Med Chem 26: 4301-4309 (2018)


Article DOI: 10.1016/j.bmc.2018.07.029
BindingDB Entry DOI: 10.7270/Q2K93B5H
More data for this
Ligand-Target Pair
DNA repair protein REV1


(Homo sapiens)
BDBM50463121
PNG
(CHEMBL4242641)
Show SMILES CCc1ccc(NC(=O)CN2CCN(CC2)c2ccccc2)cc1
Show InChI InChI=1S/C20H25N3O/c1-2-17-8-10-18(11-9-17)21-20(24)16-22-12-14-23(15-13-22)19-6-4-3-5-7-19/h3-11H,2,12-16H2,1H3,(H,21,24)
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n/an/an/a 4.95E+4n/an/an/an/an/a



University of Connecticut

Curated by ChEMBL


Assay Description
Displacement of FAM-labelled polkappa-RIR peptide from recombinant human C-terminal Rev1 (1158 to 1251 residues) expressed in Escherichia coli BL21(D...


Bioorg Med Chem 26: 4301-4309 (2018)


Article DOI: 10.1016/j.bmc.2018.07.029
BindingDB Entry DOI: 10.7270/Q2K93B5H
More data for this
Ligand-Target Pair
DNA repair protein REV1


(Homo sapiens)
BDBM50463102
PNG
(CHEMBL4241998)
Show SMILES Fc1ccc(cc1)N1CCN(CC(=O)Nc2ccc(cc2)C#N)CC1
Show InChI InChI=1S/C19H19FN4O/c20-16-3-7-18(8-4-16)24-11-9-23(10-12-24)14-19(25)22-17-5-1-15(13-21)2-6-17/h1-8H,9-12,14H2,(H,22,25)
PDB

UniProtKB/SwissProt

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AffyNet 
Purchase

PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 1.09E+5n/an/an/an/an/a



University of Connecticut

Curated by ChEMBL


Assay Description
Displacement of FAM-labelled polkappa-RIR peptide from recombinant human C-terminal Rev1 (1158 to 1251 residues) expressed in Escherichia coli BL21(D...


Bioorg Med Chem 26: 4301-4309 (2018)


Article DOI: 10.1016/j.bmc.2018.07.029
BindingDB Entry DOI: 10.7270/Q2K93B5H
More data for this
Ligand-Target Pair