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Compile Data Set for Download or QSAR

Found 123 hits with Last Name = 'vought' and Initial = 'b'   
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
Endoplasmin


(Homo sapiens (Human))
BDBM20926
PNG
(5-[2,4-dihydroxy-5-(propan-2-yl)phenyl]-N-ethyl-4-...)
Show SMILES CCNC(=O)c1noc(c1-c1ccc(CN2CCOCC2)cc1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C26H31N3O5/c1-4-27-26(32)24-23(18-7-5-17(6-8-18)15-29-9-11-33-12-10-29)25(34-28-24)20-13-19(16(2)3)21(30)14-22(20)31/h5-8,13-14,16,30-31H,4,9-12,15H2,1-3H3,(H,27,32)
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4n/an/an/an/an/an/an/an/a



Vertex Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity to human N-terminal polyHis-tagged GRP94 (L69 to N337) expressed in Escherichia coli BL21(DE3) after 3 hrs by fluorescence polarizat...


Bioorg Med Chem Lett 24: 204-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.11.036
BindingDB Entry DOI: 10.7270/Q2NP25WW
More data for this
Ligand-Target Pair
Endoplasmin


(Homo sapiens (Human))
BDBM50445479
PNG
(CHEMBL3104859)
Show SMILES CO[C@H]1C[C@H](C)Cc2c(O)c(NC(=O)C(C)=CC=C[C@@H](OC)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)[C@H]1O)cc(O)c2N=CCN(C)C |r,w:38.39,16.16,t:28|
Show InChI InChI=1S/C32H48N4O8/c1-18-14-22-27(34-12-13-36(5)6)24(37)17-23(29(22)39)35-31(40)19(2)10-9-11-25(42-7)30(44-32(33)41)21(4)16-20(3)28(38)26(15-18)43-8/h9-12,16-18,20,25-26,28,30,37-39H,13-15H2,1-8H3,(H2,33,41)(H,35,40)/b11-9?,19-10?,21-16+,34-12?/t18-,20+,25-,26+,28-,30+/m1/s1
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5n/an/an/an/an/an/an/an/a



Vertex Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity to human N-terminal polyHis-tagged GRP94 (L69 to N337) expressed in Escherichia coli BL21(DE3) after 3 hrs by fluorescence polarizat...


Bioorg Med Chem Lett 24: 204-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.11.036
BindingDB Entry DOI: 10.7270/Q2NP25WW
More data for this
Ligand-Target Pair
Heat shock protein 75 kDa, mitochondrial


(Homo sapiens (Human))
BDBM20926
PNG
(5-[2,4-dihydroxy-5-(propan-2-yl)phenyl]-N-ethyl-4-...)
Show SMILES CCNC(=O)c1noc(c1-c1ccc(CN2CCOCC2)cc1)-c1cc(C(C)C)c(O)cc1O
Show InChI InChI=1S/C26H31N3O5/c1-4-27-26(32)24-23(18-7-5-17(6-8-18)15-29-9-11-33-12-10-29)25(34-28-24)20-13-19(16(2)3)21(30)14-22(20)31/h5-8,13-14,16,30-31H,4,9-12,15H2,1-3H3,(H,27,32)
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16n/an/an/an/an/an/an/an/a



Vertex Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant TRAP1 after 3 hrs by fluorescence polarization assay


Bioorg Med Chem Lett 24: 204-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.11.036
BindingDB Entry DOI: 10.7270/Q2NP25WW
More data for this
Ligand-Target Pair
Heat shock protein 75 kDa, mitochondrial


(Homo sapiens (Human))
BDBM20800
PNG
(2-amino-6-halopurine analogue, 20 | 6-chloro-9-[(4...)
Show SMILES COc1c(C)cnc(Cn2cnc3c(Cl)nc(N)nc23)c1C
Show InChI InChI=1S/C14H15ClN6O/c1-7-4-17-9(8(2)11(7)22-3)5-21-6-18-10-12(15)19-14(16)20-13(10)21/h4,6H,5H2,1-3H3,(H2,16,19,20)
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62n/an/an/an/an/an/an/an/a



Vertex Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant TRAP1 after 3 hrs by fluorescence polarization assay


Bioorg Med Chem Lett 24: 204-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.11.036
BindingDB Entry DOI: 10.7270/Q2NP25WW
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Endoplasmin


(Homo sapiens (Human))
BDBM20800
PNG
(2-amino-6-halopurine analogue, 20 | 6-chloro-9-[(4...)
Show SMILES COc1c(C)cnc(Cn2cnc3c(Cl)nc(N)nc23)c1C
Show InChI InChI=1S/C14H15ClN6O/c1-7-4-17-9(8(2)11(7)22-3)5-21-6-18-10-12(15)19-14(16)20-13(10)21/h4,6H,5H2,1-3H3,(H2,16,19,20)
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176n/an/an/an/an/an/an/an/a



Vertex Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity to human N-terminal polyHis-tagged GRP94 (L69 to N337) expressed in Escherichia coli BL21(DE3) after 3 hrs by fluorescence polarizat...


Bioorg Med Chem Lett 24: 204-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.11.036
BindingDB Entry DOI: 10.7270/Q2NP25WW
More data for this
Ligand-Target Pair
Heat shock protein 75 kDa, mitochondrial


(Homo sapiens (Human))
BDBM50445479
PNG
(CHEMBL3104859)
Show SMILES CO[C@H]1C[C@H](C)Cc2c(O)c(NC(=O)C(C)=CC=C[C@@H](OC)[C@@H](OC(N)=O)\C(C)=C\[C@H](C)[C@H]1O)cc(O)c2N=CCN(C)C |r,w:38.39,16.16,t:28|
Show InChI InChI=1S/C32H48N4O8/c1-18-14-22-27(34-12-13-36(5)6)24(37)17-23(29(22)39)35-31(40)19(2)10-9-11-25(42-7)30(44-32(33)41)21(4)16-20(3)28(38)26(15-18)43-8/h9-12,16-18,20,25-26,28,30,37-39H,13-15H2,1-8H3,(H2,33,41)(H,35,40)/b11-9?,19-10?,21-16+,34-12?/t18-,20+,25-,26+,28-,30+/m1/s1
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326n/an/an/an/an/an/an/an/a



Vertex Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant TRAP1 after 3 hrs by fluorescence polarization assay


Bioorg Med Chem Lett 24: 204-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.11.036
BindingDB Entry DOI: 10.7270/Q2NP25WW
More data for this
Ligand-Target Pair
Endoplasmin


(Homo sapiens (Human))
BDBM50445478
PNG
(CHEMBL3104858)
Show SMILES Cc1cn(c2CC(C)(C)CC(=O)c12)-c1cc(F)c(C(N)=O)c(N[C@H]2CCOC2)c1 |r|
Show InChI InChI=1S/C22H26FN3O3/c1-12-10-26(17-8-22(2,3)9-18(27)19(12)17)14-6-15(23)20(21(24)28)16(7-14)25-13-4-5-29-11-13/h6-7,10,13,25H,4-5,8-9,11H2,1-3H3,(H2,24,28)/t13-/m0/s1
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375n/an/an/an/an/an/an/an/a



Vertex Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity to human N-terminal polyHis-tagged GRP94 (L69 to N337) expressed in Escherichia coli BL21(DE3) after 3 hrs by fluorescence polarizat...


Bioorg Med Chem Lett 24: 204-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.11.036
BindingDB Entry DOI: 10.7270/Q2NP25WW
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Endoplasmin


(Homo sapiens (Human))
BDBM50378702
PNG
(CHEMBL560895 | SNX-2112)
Show SMILES CC1(C)Cc2c(c(nn2-c2ccc(C(N)=O)c(NC3CCC(O)CC3)c2)C(F)(F)F)C(=O)C1
Show InChI InChI=1S/C23H27F3N4O3/c1-22(2)10-17-19(18(32)11-22)20(23(24,25)26)29-30(17)13-5-8-15(21(27)33)16(9-13)28-12-3-6-14(31)7-4-12/h5,8-9,12,14,28,31H,3-4,6-7,10-11H2,1-2H3,(H2,27,33)/t12-,14-
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484n/an/an/an/an/an/an/an/a



Vertex Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity to human N-terminal polyHis-tagged GRP94 (L69 to N337) expressed in Escherichia coli BL21(DE3) after 3 hrs by fluorescence polarizat...


Bioorg Med Chem Lett 24: 204-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.11.036
BindingDB Entry DOI: 10.7270/Q2NP25WW
More data for this
Ligand-Target Pair
Heat shock protein 75 kDa, mitochondrial


(Homo sapiens (Human))
BDBM50378702
PNG
(CHEMBL560895 | SNX-2112)
Show SMILES CC1(C)Cc2c(c(nn2-c2ccc(C(N)=O)c(NC3CCC(O)CC3)c2)C(F)(F)F)C(=O)C1
Show InChI InChI=1S/C23H27F3N4O3/c1-22(2)10-17-19(18(32)11-22)20(23(24,25)26)29-30(17)13-5-8-15(21(27)33)16(9-13)28-12-3-6-14(31)7-4-12/h5,8-9,12,14,28,31H,3-4,6-7,10-11H2,1-2H3,(H2,27,33)/t12-,14-
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791n/an/an/an/an/an/an/an/a



Vertex Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant TRAP1 after 3 hrs by fluorescence polarization assay


Bioorg Med Chem Lett 24: 204-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.11.036
BindingDB Entry DOI: 10.7270/Q2NP25WW
More data for this
Ligand-Target Pair
Heat shock protein 75 kDa, mitochondrial


(Homo sapiens (Human))
BDBM50445478
PNG
(CHEMBL3104858)
Show SMILES Cc1cn(c2CC(C)(C)CC(=O)c12)-c1cc(F)c(C(N)=O)c(N[C@H]2CCOC2)c1 |r|
Show InChI InChI=1S/C22H26FN3O3/c1-12-10-26(17-8-22(2,3)9-18(27)19(12)17)14-6-15(23)20(21(24)28)16(7-14)25-13-4-5-29-11-13/h6-7,10,13,25H,4-5,8-9,11H2,1-3H3,(H2,24,28)/t13-/m0/s1
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1.20E+3n/an/an/an/an/an/an/an/a



Vertex Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity to human recombinant TRAP1 after 3 hrs by fluorescence polarization assay


Bioorg Med Chem Lett 24: 204-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.11.036
BindingDB Entry DOI: 10.7270/Q2NP25WW
More data for this
Ligand-Target Pair
Endoplasmin


(Homo sapiens (Human))
BDBM50445480
PNG
(CHEMBL3104860)
Show SMILES CC1(C)Cc2c(ccn2-c2cc(F)c(C(N)=O)c(N[C@H]3CCOC3)c2)C(=O)C1 |r|
Show InChI InChI=1S/C21H24FN3O3/c1-21(2)9-17-14(18(26)10-21)3-5-25(17)13-7-15(22)19(20(23)27)16(8-13)24-12-4-6-28-11-12/h3,5,7-8,12,24H,4,6,9-11H2,1-2H3,(H2,23,27)/t12-/m0/s1
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2.65E+3n/an/an/an/an/an/an/an/a



Vertex Pharmaceuticals

Curated by ChEMBL


Assay Description
Binding affinity to human N-terminal polyHis-tagged GRP94 (L69 to N337) expressed in Escherichia coli BL21(DE3) after 3 hrs by fluorescence polarizat...


Bioorg Med Chem Lett 24: 204-8 (2013)


Article DOI: 10.1016/j.bmcl.2013.11.036
BindingDB Entry DOI: 10.7270/Q2NP25WW
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596133
PNG
(CHEMBL5081193)
Show SMILES Fc1cc(ccn1)-n1ccc(NC(=O)C2(CC2)c2ccccc2F)n1
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n/an/a 5n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596133
PNG
(CHEMBL5081193)
Show SMILES Fc1cc(ccn1)-n1ccc(NC(=O)C2(CC2)c2ccccc2F)n1
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TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596133
PNG
(CHEMBL5081193)
Show SMILES Fc1cc(ccn1)-n1ccc(NC(=O)C2(CC2)c2ccccc2F)n1
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TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596154
PNG
(CHEMBL5169448)
Show SMILES Fc1ccccc1C1(CC1)C(=O)Nc1ccn(n1)-c1ccccc1
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TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596133
PNG
(CHEMBL5081193)
Show SMILES Fc1cc(ccn1)-n1ccc(NC(=O)C2(CC2)c2ccccc2F)n1
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TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596133
PNG
(CHEMBL5081193)
Show SMILES Fc1cc(ccn1)-n1ccc(NC(=O)C2(CC2)c2ccccc2F)n1
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TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596133
PNG
(CHEMBL5081193)
Show SMILES Fc1cc(ccn1)-n1ccc(NC(=O)C2(CC2)c2ccccc2F)n1
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TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596176
PNG
(CHEMBL5185729)
Show SMILES Fc1cncc(c1)-n1ccc(NC(=O)C2(CC2)c2c(F)cccc2F)n1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596133
PNG
(CHEMBL5081193)
Show SMILES Fc1cc(ccn1)-n1ccc(NC(=O)C2(CC2)c2ccccc2F)n1
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TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596163
PNG
(CHEMBL5206398)
Show SMILES Fc1ccccc1C1(CC1)C(=O)Nc1ccn(n1)-c1ncns1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596161
PNG
(CHEMBL5203823)
Show SMILES Fc1cncc(c1)-n1ccc(NC(=O)C2(CC2)c2ccccc2F)n1
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TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596133
PNG
(CHEMBL5081193)
Show SMILES Fc1cc(ccn1)-n1ccc(NC(=O)C2(CC2)c2ccccc2F)n1
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TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596146
PNG
(CHEMBL5204141)
Show SMILES O=C(Nc1ccn(n1)-c1ccccc1)C1(CC1)c1ccccc1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596164
PNG
(CHEMBL5172768)
Show SMILES Fc1cncc(c1)-n1ccc(NC(=O)C2(CC2)c2ccccc2)n1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596162
PNG
(CHEMBL5185644)
Show SMILES Fc1ccc(cn1)-n1ccc(NC(=O)C2(CC2)c2ccccc2F)n1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596160
PNG
(CHEMBL5205200)
Show SMILES Fc1ccccc1C1(CC1)C(=O)Nc1ccn(n1)-c1ccncn1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596145
PNG
(CHEMBL5199478)
Show SMILES C[C@H](C(=O)Nc1ccn(n1)-c1ccccc1)c1ccccc1 |r|
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596133
PNG
(CHEMBL5081193)
Show SMILES Fc1cc(ccn1)-n1ccc(NC(=O)C2(CC2)c2ccccc2F)n1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596157
PNG
(CHEMBL5194186)
Show SMILES COc1cc(ccn1)-n1ccc(NC(=O)C2(CC2)c2ccccc2F)n1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596135
PNG
(CHEMBL5190392)
Show SMILES Fc1ccccc1CC(=O)Nc1ccn(n1)-c1ccccc1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596143
PNG
(CHEMBL5200554)
Show SMILES O=C(Cc1ccccc1)Nc1ccn(n1)-c1ccccc1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596155
PNG
(CHEMBL5174762)
Show SMILES Fc1ccccc1C1(CC1)C(=O)Nc1ccn(n1)-c1ccncc1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596172
PNG
(CHEMBL5204609)
Show SMILES Fc1ccc(cc1)C1(CC1)C(=O)Nc1ccn(n1)-c1cncc(F)c1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596175
PNG
(CHEMBL5192322)
Show SMILES Fc1cncc(c1)-n1ccc(NC(=O)C2(CC2)c2ccc(cc2)C#N)n1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596165
PNG
(CHEMBL5202816)
Show SMILES Fc1cncc(c1)-n1ccc(NC(=O)C2(CC2)c2ccccc2Cl)n1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596150
PNG
(CHEMBL5182190)
Show SMILES FC1(F)CC1(C(=O)Nc1ccn(n1)-c1ccccc1)c1ccccc1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596177
PNG
(CHEMBL5188173)
Show SMILES Fc1cncc(c1)-n1ccc(NC(=O)C2(CC2)c2cccc(F)c2F)n1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596178
PNG
(CHEMBL5202203)
Show SMILES Fc1ccc(F)c(c1)C1(CC1)C(=O)Nc1ccn(n1)-c1cncc(F)c1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596170
PNG
(CHEMBL5200718)
Show SMILES COc1cccc(c1)C1(CC1)C(=O)Nc1ccn(n1)-c1cncc(F)c1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596169
PNG
(CHEMBL5190417)
Show SMILES Fc1cccc(c1)C1(CC1)C(=O)Nc1ccn(n1)-c1cncc(F)c1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596144
PNG
(CHEMBL5194918)
Show SMILES C[C@@H](C(=O)Nc1ccn(n1)-c1ccccc1)c1ccccc1 |r|
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596153
PNG
(CHEMBL5202062)
Show SMILES O=C(Nc1ccn(n1)-c1ccccc1)C1(COC1)c1ccccc1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596134
PNG
(CHEMBL5178289)
Show SMILES Fc1ccccc1CC(=O)Nc1nc(cs1)-c1ccccc1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596148
PNG
(CHEMBL5174196)
Show SMILES CC(C)(C(=O)Nc1ccn(n1)-c1ccccc1)c1ccccc1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596171
PNG
(CHEMBL5202263)
Show SMILES Fc1cncc(c1)-n1ccc(NC(=O)C2(CC2)c2cccc(c2)C#N)n1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596173
PNG
(CHEMBL5207495)
Show SMILES Fc1cncc(c1)-n1ccc(NC(=O)C2(CC2)c2ccc(Cl)cc2)n1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596166
PNG
(CHEMBL5190980)
Show SMILES Cc1ccccc1C1(CC1)C(=O)Nc1ccn(n1)-c1cncc(F)c1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596163
PNG
(CHEMBL5206398)
Show SMILES Fc1ccccc1C1(CC1)C(=O)Nc1ccn(n1)-c1ncns1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
Elongation of very long chain fatty acids protein 1


(Homo sapiens (Human))
BDBM50596146
PNG
(CHEMBL5204141)
Show SMILES O=C(Nc1ccn(n1)-c1ccccc1)C1(CC1)c1ccccc1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00944
BindingDB Entry DOI: 10.7270/Q22R3WPP
More data for this
Ligand-Target Pair
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