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Compile Data Set for Download or QSAR

Found 5 hits of kd for UniProtKB: P61077   
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
Ubiquitin-conjugating enzyme E2 D3


(Homo sapiens)
BDBM50249751
PNG
(CHEMBL4080789)
Show SMILES [H][C@@]12CCc3c(C)cc(OCc4ccccc4Br)c(C)c3[C@]1([H])OC(=O)C2=C |r|
Show InChI InChI=1S/C22H21BrO3/c1-12-10-19(25-11-15-6-4-5-7-18(15)23)14(3)20-16(12)8-9-17-13(2)22(24)26-21(17)20/h4-7,10,17,21H,2,8-9,11H2,1,3H3/t17-,21+/m0/s1
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n/an/an/a 283n/an/an/an/an/a



School of Pharmacy, Second Military Medical University , Shanghai 200433, China.

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant UbcH5c by SPR analysis


J Med Chem 60: 6828-6852 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01829
BindingDB Entry DOI: 10.7270/Q2SX6GP3
More data for this
Ligand-Target Pair
Ubiquitin-conjugating enzyme E2 D3


(Homo sapiens)
BDBM50249761
PNG
(CHEMBL4071335)
Show SMILES [H][C@@]12CC[C@@]3(C)CC[C@H](OC(=O)c4ccc(I)cc4)[C@H](C)C3[C@@]1([H])OC(=O)C2=C |r|
Show InChI InChI=1S/C22H25IO4/c1-12-16-8-10-22(3)11-9-17(13(2)18(22)19(16)27-20(12)24)26-21(25)14-4-6-15(23)7-5-14/h4-7,13,16-19H,1,8-11H2,2-3H3/t13-,16-,17-,18?,19-,22-/m0/s1
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n/an/an/a 353n/an/an/an/an/a



School of Pharmacy, Second Military Medical University , Shanghai 200433, China.

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant UbcH5c by SPR analysis


J Med Chem 60: 6828-6852 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01829
BindingDB Entry DOI: 10.7270/Q2SX6GP3
More data for this
Ligand-Target Pair
Ubiquitin-conjugating enzyme E2 D3


(Homo sapiens)
BDBM50249753
PNG
(CHEMBL4082171)
Show SMILES [H][C@@]12C[C@@]3(C)[C@H](O)CC[C@H](C)C3=C[C@]1([H])C(=C)C(=O)O2 |r,c:12|
Show InChI InChI=1S/C15H20O3/c1-8-4-5-13(16)15(3)7-12-10(6-11(8)15)9(2)14(17)18-12/h6,8,10,12-13,16H,2,4-5,7H2,1,3H3/t8-,10+,12+,13+,15+/m0/s1
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n/an/an/a 2.58E+3n/an/an/an/an/a



School of Pharmacy, Second Military Medical University , Shanghai 200433, China.

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant UbcH5c by SPR analysis


J Med Chem 60: 6828-6852 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01829
BindingDB Entry DOI: 10.7270/Q2SX6GP3
More data for this
Ligand-Target Pair
Ubiquitin-conjugating enzyme E2 D3


(Homo sapiens)
BDBM50249760
PNG
(CHEMBL4100955)
Show SMILES [H][C@@]12CC[C@@](C)(OC(C)=O)C3C[C@H](OC(=O)c4ccc(Cl)cc4)C(C)=C3[C@@]1([H])OC(=O)C2=C |r,c:25|
Show InChI InChI=1S/C24H25ClO6/c1-12-17-9-10-24(4,31-14(3)26)18-11-19(13(2)20(18)21(17)30-22(12)27)29-23(28)15-5-7-16(25)8-6-15/h5-8,17-19,21H,1,9-11H2,2-4H3/t17-,18?,19-,21-,24+/m0/s1
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n/an/an/a 3.64E+3n/an/an/an/an/a



School of Pharmacy, Second Military Medical University , Shanghai 200433, China.

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant UbcH5c by SPR analysis


J Med Chem 60: 6828-6852 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01829
BindingDB Entry DOI: 10.7270/Q2SX6GP3
More data for this
Ligand-Target Pair
Ubiquitin-conjugating enzyme E2 D3


(Homo sapiens)
BDBM50249752
PNG
(CHEMBL4098033)
Show SMILES [H][C@@]12CC[C@@]3(C)CC[C@H](OC(=O)c4cccc(I)c4)[C@H](C)C3[C@@]1([H])OC(=O)C2=C |r|
Show InChI InChI=1S/C22H25IO4/c1-12-16-7-9-22(3)10-8-17(13(2)18(22)19(16)27-20(12)24)26-21(25)14-5-4-6-15(23)11-14/h4-6,11,13,16-19H,1,7-10H2,2-3H3/t13-,16-,17-,18?,19-,22-/m0/s1
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n/an/an/a 6.40E+3n/an/an/an/an/a



School of Pharmacy, Second Military Medical University , Shanghai 200433, China.

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant UbcH5c by SPR analysis


J Med Chem 60: 6828-6852 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01829
BindingDB Entry DOI: 10.7270/Q2SX6GP3
More data for this
Ligand-Target Pair