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Compile Data Set for Download or QSAR

Found 22 hits Enz. Inhib. hit(s) with all data for entry = 50049096   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Ubiquitin carboxyl-terminal hydrolase 7


(Homo sapiens (Human))
BDBM50234351
PNG
(CHEMBL4092836)
Show SMILES CC(=O)c1nc(c(Sc2c(Cl)cncc2Cl)s1)[N+]([O-])=O
Show InChI InChI=1S/C10H5Cl2N3O3S2/c1-4(16)9-14-8(15(17)18)10(20-9)19-7-5(11)2-13-3-6(7)12/h2-3H,1H3
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n/an/a 670n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of USP7 (unknown origin) using Ub-Rho as substrate preincubated for 30 mins followed by substrate addition and subsequent incubation in da...


Bioorg Med Chem Lett 27: 845-849 (2017)


Article DOI: 10.1016/j.bmcl.2017.01.018
BindingDB Entry DOI: 10.7270/Q20Z75HQ
More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 7


(Homo sapiens (Human))
BDBM50234340
PNG
(CHEMBL4097876)
Show SMILES [O-][N+](=O)c1nc(sc1Sc1c(Cl)cncc1Cl)C(=O)NCc1cccc(F)c1
Show InChI InChI=1S/C16H9Cl2FN4O3S2/c17-10-6-20-7-11(18)12(10)27-16-13(23(25)26)22-15(28-16)14(24)21-5-8-2-1-3-9(19)4-8/h1-4,6-7H,5H2,(H,21,24)
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n/an/a 1.35E+3n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of USP7 (unknown origin) using Ub-Rho as substrate preincubated for 30 mins followed by substrate addition and subsequent incubation in da...


Bioorg Med Chem Lett 27: 845-849 (2017)


Article DOI: 10.1016/j.bmcl.2017.01.018
BindingDB Entry DOI: 10.7270/Q20Z75HQ
More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 7


(Homo sapiens (Human))
BDBM50234341
PNG
(CHEMBL4079850)
Show SMILES [O-][N+](=O)c1nc(sc1Sc1c(Cl)cncc1Cl)C(=O)NCc1ccc(F)cc1
Show InChI InChI=1S/C16H9Cl2FN4O3S2/c17-10-6-20-7-11(18)12(10)27-16-13(23(25)26)22-15(28-16)14(24)21-5-8-1-3-9(19)4-2-8/h1-4,6-7H,5H2,(H,21,24)
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n/an/a 2.65E+3n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of USP7 (unknown origin) using Ub-Rho as substrate preincubated for 30 mins followed by substrate addition and subsequent incubation in da...


Bioorg Med Chem Lett 27: 845-849 (2017)


Article DOI: 10.1016/j.bmcl.2017.01.018
BindingDB Entry DOI: 10.7270/Q20Z75HQ
More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 7


(Homo sapiens (Human))
BDBM50234353
PNG
(CHEMBL4087728)
Show SMILES Cc1ccc(CNC(=O)c2nc(c(Sc3c(Cl)cncc3Cl)s2)[N+]([O-])=O)cc1
Show InChI InChI=1S/C17H12Cl2N4O3S2/c1-9-2-4-10(5-3-9)6-21-15(24)16-22-14(23(25)26)17(28-16)27-13-11(18)7-20-8-12(13)19/h2-5,7-8H,6H2,1H3,(H,21,24)
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n/an/a 3.65E+3n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of USP7 (unknown origin) using Ub-Rho as substrate preincubated for 30 mins followed by substrate addition and subsequent incubation in da...


Bioorg Med Chem Lett 27: 845-849 (2017)


Article DOI: 10.1016/j.bmcl.2017.01.018
BindingDB Entry DOI: 10.7270/Q20Z75HQ
More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 7


(Homo sapiens (Human))
BDBM50234344
PNG
(CHEMBL4069093)
Show SMILES [O-][N+](=O)c1nc(sc1Sc1c(Cl)cncc1Cl)C(=O)NCc1ccccc1
Show InChI InChI=1S/C16H10Cl2N4O3S2/c17-10-7-19-8-11(18)12(10)26-16-13(22(24)25)21-15(27-16)14(23)20-6-9-4-2-1-3-5-9/h1-5,7-8H,6H2,(H,20,23)
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n/an/a 4.21E+3n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of USP7 (unknown origin) using Ub-Rho as substrate preincubated for 30 mins followed by substrate addition and subsequent incubation in da...


Bioorg Med Chem Lett 27: 845-849 (2017)


Article DOI: 10.1016/j.bmcl.2017.01.018
BindingDB Entry DOI: 10.7270/Q20Z75HQ
More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 7


(Homo sapiens (Human))
BDBM50234342
PNG
(CHEMBL4065173)
Show SMILES CC(=O)c1nc(c(Sc2c(Cl)cccc2Cl)s1)[N+]([O-])=O
Show InChI InChI=1S/C11H6Cl2N2O3S2/c1-5(16)10-14-9(15(17)18)11(20-10)19-8-6(12)3-2-4-7(8)13/h2-4H,1H3
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n/an/a 4.49E+3n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of USP7 (unknown origin) using Ub-Rho as substrate preincubated for 30 mins followed by substrate addition and subsequent incubation in da...


Bioorg Med Chem Lett 27: 845-849 (2017)


Article DOI: 10.1016/j.bmcl.2017.01.018
BindingDB Entry DOI: 10.7270/Q20Z75HQ
More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 7


(Homo sapiens (Human))
BDBM50234350
PNG
(CHEMBL4100573)
Show SMILES CCCC(=O)OC(C)c1nc(c(Sc2c(Cl)cncc2Cl)s1)[N+]([O-])=O
Show InChI InChI=1S/C14H13Cl2N3O4S2/c1-3-4-10(20)23-7(2)13-18-12(19(21)22)14(25-13)24-11-8(15)5-17-6-9(11)16/h5-7H,3-4H2,1-2H3
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n/an/a 4.49E+3n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of USP7 (unknown origin) using Ub-Rho as substrate preincubated for 30 mins followed by substrate addition and subsequent incubation in da...


Bioorg Med Chem Lett 27: 845-849 (2017)


Article DOI: 10.1016/j.bmcl.2017.01.018
BindingDB Entry DOI: 10.7270/Q20Z75HQ
More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 7


(Homo sapiens (Human))
BDBM50234339
PNG
(CHEMBL4105608)
Show SMILES CC(=O)c1nc(c(Sc2ccc(F)cc2F)s1)[N+]([O-])=O
Show InChI InChI=1S/C11H6F2N2O3S2/c1-5(16)10-14-9(15(17)18)11(20-10)19-8-3-2-6(12)4-7(8)13/h2-4H,1H3
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n/an/a 6.12E+3n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of USP7 (unknown origin) using Ub-Rho as substrate preincubated for 30 mins followed by substrate addition and subsequent incubation in da...


Bioorg Med Chem Lett 27: 845-849 (2017)


Article DOI: 10.1016/j.bmcl.2017.01.018
BindingDB Entry DOI: 10.7270/Q20Z75HQ
More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 7


(Homo sapiens (Human))
BDBM50234338
PNG
(CHEMBL4062409)
Show SMILES CC(O)c1nc(c(Sc2c(Cl)cncc2Cl)s1)[N+]([O-])=O
Show InChI InChI=1S/C10H7Cl2N3O3S2/c1-4(16)9-14-8(15(17)18)10(20-9)19-7-5(11)2-13-3-6(7)12/h2-4,16H,1H3
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n/an/a 6.95E+3n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of USP7 (unknown origin) using Ub-Rho as substrate preincubated for 30 mins followed by substrate addition and subsequent incubation in da...


Bioorg Med Chem Lett 27: 845-849 (2017)


Article DOI: 10.1016/j.bmcl.2017.01.018
BindingDB Entry DOI: 10.7270/Q20Z75HQ
More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 7


(Homo sapiens (Human))
BDBM50234345
PNG
(CHEMBL4070513)
Show SMILES CC(=O)c1nc(c(Sc2cccc(Cl)c2Cl)s1)[N+]([O-])=O
Show InChI InChI=1S/C11H6Cl2N2O3S2/c1-5(16)10-14-9(15(17)18)11(20-10)19-7-4-2-3-6(12)8(7)13/h2-4H,1H3
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n/an/a 9.93E+3n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of USP7 (unknown origin) using Ub-Rho as substrate preincubated for 30 mins followed by substrate addition and subsequent incubation in da...


Bioorg Med Chem Lett 27: 845-849 (2017)


Article DOI: 10.1016/j.bmcl.2017.01.018
BindingDB Entry DOI: 10.7270/Q20Z75HQ
More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 7


(Homo sapiens (Human))
BDBM50234343
PNG
(CHEMBL4094344)
Show SMILES CC(=O)c1nc(c(Sc2ccc(Cl)cc2Cl)s1)[N+]([O-])=O
Show InChI InChI=1S/C11H6Cl2N2O3S2/c1-5(16)10-14-9(15(17)18)11(20-10)19-8-3-2-6(12)4-7(8)13/h2-4H,1H3
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n/an/a 1.68E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of USP7 (unknown origin) using Ub-Rho as substrate preincubated for 30 mins followed by substrate addition and subsequent incubation in da...


Bioorg Med Chem Lett 27: 845-849 (2017)


Article DOI: 10.1016/j.bmcl.2017.01.018
BindingDB Entry DOI: 10.7270/Q20Z75HQ
More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 7


(Homo sapiens (Human))
BDBM50234352
PNG
(CHEMBL4073748)
Show SMILES CC(=O)c1nc(c(Sc2ccc(Cl)c(Cl)c2)s1)[N+]([O-])=O
Show InChI InChI=1S/C11H6Cl2N2O3S2/c1-5(16)10-14-9(15(17)18)11(20-10)19-6-2-3-7(12)8(13)4-6/h2-4H,1H3
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n/an/a 1.80E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of USP7 (unknown origin) using Ub-Rho as substrate preincubated for 30 mins followed by substrate addition and subsequent incubation in da...


Bioorg Med Chem Lett 27: 845-849 (2017)


Article DOI: 10.1016/j.bmcl.2017.01.018
BindingDB Entry DOI: 10.7270/Q20Z75HQ
More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 7


(Homo sapiens (Human))
BDBM50393440
PNG
(CHEMBL2159498)
Show SMILES CC(=O)c1cc(c(Sc2ccc(F)cc2F)s1)[N+]([O-])=O
Show InChI InChI=1S/C12H7F2NO3S2/c1-6(16)11-5-9(15(17)18)12(20-11)19-10-3-2-7(13)4-8(10)14/h2-5H,1H3
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n/an/a 1.93E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of USP7 (unknown origin) using Ub-Rho as substrate preincubated for 30 mins followed by substrate addition and subsequent incubation in da...


Bioorg Med Chem Lett 27: 845-849 (2017)


Article DOI: 10.1016/j.bmcl.2017.01.018
BindingDB Entry DOI: 10.7270/Q20Z75HQ
More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 7


(Homo sapiens (Human))
BDBM50234356
PNG
(CHEMBL4081614)
Show SMILES CC(NCc1ccccc1)c1nc(c(Sc2c(Cl)cncc2Cl)s1)[N+]([O-])=O
Show InChI InChI=1S/C17H14Cl2N4O2S2/c1-10(21-7-11-5-3-2-4-6-11)16-22-15(23(24)25)17(27-16)26-14-12(18)8-20-9-13(14)19/h2-6,8-10,21H,7H2,1H3
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n/an/a 2.68E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of USP7 (unknown origin) using Ub-Rho as substrate preincubated for 30 mins followed by substrate addition and subsequent incubation in da...


Bioorg Med Chem Lett 27: 845-849 (2017)


Article DOI: 10.1016/j.bmcl.2017.01.018
BindingDB Entry DOI: 10.7270/Q20Z75HQ
More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 7


(Homo sapiens (Human))
BDBM50234357
PNG
(CHEMBL4090158)
Show SMILES [O-][N+](=O)c1nc(sc1Sc1c(Cl)cncc1Cl)C(=O)Nc1ccccc1
Show InChI InChI=1S/C15H8Cl2N4O3S2/c16-9-6-18-7-10(17)11(9)25-15-12(21(23)24)20-14(26-15)13(22)19-8-4-2-1-3-5-8/h1-7H,(H,19,22)
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n/an/a 4.05E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of USP7 (unknown origin) using Ub-Rho as substrate preincubated for 30 mins followed by substrate addition and subsequent incubation in da...


Bioorg Med Chem Lett 27: 845-849 (2017)


Article DOI: 10.1016/j.bmcl.2017.01.018
BindingDB Entry DOI: 10.7270/Q20Z75HQ
More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 7


(Homo sapiens (Human))
BDBM50234347
PNG
(CHEMBL4073763)
Show SMILES CC(OC(C)=O)c1nc(c(Sc2c(Cl)cncc2Cl)s1)[N+]([O-])=O
Show InChI InChI=1S/C12H9Cl2N3O4S2/c1-5(21-6(2)18)11-16-10(17(19)20)12(23-11)22-9-7(13)3-15-4-8(9)14/h3-5H,1-2H3
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n/an/a>5.00E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of USP7 (unknown origin) using Ub-Rho as substrate preincubated for 30 mins followed by substrate addition and subsequent incubation in da...


Bioorg Med Chem Lett 27: 845-849 (2017)


Article DOI: 10.1016/j.bmcl.2017.01.018
BindingDB Entry DOI: 10.7270/Q20Z75HQ
More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 7


(Homo sapiens (Human))
BDBM50234355
PNG
(CHEMBL4084117)
Show SMILES CC(=O)c1nc(c(NCc2ccc(Cl)c(Cl)c2)s1)[N+]([O-])=O
Show InChI InChI=1S/C12H9Cl2N3O3S/c1-6(18)11-16-10(17(19)20)12(21-11)15-5-7-2-3-8(13)9(14)4-7/h2-4,15H,5H2,1H3
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n/an/a>5.00E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of USP7 (unknown origin) using Ub-Rho as substrate preincubated for 30 mins followed by substrate addition and subsequent incubation in da...


Bioorg Med Chem Lett 27: 845-849 (2017)


Article DOI: 10.1016/j.bmcl.2017.01.018
BindingDB Entry DOI: 10.7270/Q20Z75HQ
More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 7


(Homo sapiens (Human))
BDBM50234349
PNG
(CHEMBL4059609)
Show SMILES CC(=O)c1ncc(Sc2cccc(Cl)c2Cl)s1
Show InChI InChI=1S/C11H7Cl2NOS2/c1-6(15)11-14-5-9(17-11)16-8-4-2-3-7(12)10(8)13/h2-5H,1H3
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n/an/a>5.00E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of USP7 (unknown origin) using Ub-Rho as substrate preincubated for 30 mins followed by substrate addition and subsequent incubation in da...


Bioorg Med Chem Lett 27: 845-849 (2017)


Article DOI: 10.1016/j.bmcl.2017.01.018
BindingDB Entry DOI: 10.7270/Q20Z75HQ
More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 7


(Homo sapiens (Human))
BDBM50234346
PNG
(CHEMBL4103033)
Show SMILES COc1cccc(Sc2sc(nc2[N+]([O-])=O)C(C)=O)c1
Show InChI InChI=1S/C12H10N2O4S2/c1-7(15)11-13-10(14(16)17)12(20-11)19-9-5-3-4-8(6-9)18-2/h3-6H,1-2H3
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n/an/a>5.00E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of USP7 (unknown origin) using Ub-Rho as substrate preincubated for 30 mins followed by substrate addition and subsequent incubation in da...


Bioorg Med Chem Lett 27: 845-849 (2017)


Article DOI: 10.1016/j.bmcl.2017.01.018
BindingDB Entry DOI: 10.7270/Q20Z75HQ
More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 7


(Homo sapiens (Human))
BDBM50234354
PNG
(CHEMBL4085087)
Show SMILES COc1ccc(Sc2sc(nc2[N+]([O-])=O)C(C)=O)cc1OC
Show InChI InChI=1S/C13H12N2O5S2/c1-7(16)12-14-11(15(17)18)13(22-12)21-8-4-5-9(19-2)10(6-8)20-3/h4-6H,1-3H3
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n/an/a>5.00E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of USP7 (unknown origin) using Ub-Rho as substrate preincubated for 30 mins followed by substrate addition and subsequent incubation in da...


Bioorg Med Chem Lett 27: 845-849 (2017)


Article DOI: 10.1016/j.bmcl.2017.01.018
BindingDB Entry DOI: 10.7270/Q20Z75HQ
More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 7


(Homo sapiens (Human))
BDBM50234359
PNG
(CHEMBL4076683)
Show SMILES CC(=O)c1ncc(Sc2ccc(Cl)c(Cl)c2)s1
Show InChI InChI=1S/C11H7Cl2NOS2/c1-6(15)11-14-5-10(17-11)16-7-2-3-8(12)9(13)4-7/h2-5H,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a>5.00E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of USP7 (unknown origin) using Ub-Rho as substrate preincubated for 30 mins followed by substrate addition and subsequent incubation in da...


Bioorg Med Chem Lett 27: 845-849 (2017)


Article DOI: 10.1016/j.bmcl.2017.01.018
BindingDB Entry DOI: 10.7270/Q20Z75HQ
More data for this
Ligand-Target Pair
Ubiquitin carboxyl-terminal hydrolase 7


(Homo sapiens (Human))
BDBM50234358
PNG
(CHEMBL4099610)
Show SMILES CC(OC(=O)c1ccccc1)c1nc(c(Sc2c(Cl)cncc2Cl)s1)[N+]([O-])=O
Show InChI InChI=1S/C17H11Cl2N3O4S2/c1-9(26-16(23)10-5-3-2-4-6-10)15-21-14(22(24)25)17(28-15)27-13-11(18)7-20-8-12(13)19/h2-9H,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a>5.00E+4n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of USP7 (unknown origin) using Ub-Rho as substrate preincubated for 30 mins followed by substrate addition and subsequent incubation in da...


Bioorg Med Chem Lett 27: 845-849 (2017)


Article DOI: 10.1016/j.bmcl.2017.01.018
BindingDB Entry DOI: 10.7270/Q20Z75HQ
More data for this
Ligand-Target Pair