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Found 285 hits Enz. Inhib. hit(s) with Target = 'Alpha-ketoglutarate-dependent dioxygenase FTO'   
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
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM589235
PNG
(US11555009, Compound 15 | US11555009, Compound 29)
Show SMILES Cc1noc(C)c1-c1cc(Cl)c(Nc2ccccc2C(O)=O)c(Cl)c1
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TBA

Assay Description
The present invention provides a novel class of demethylase FTO inhibitors which inhibit FTO protein activity at very low concentration (typically IC...


Citation and Details

BindingDB Entry DOI: 10.7270/Q22B92ZG
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM589235
PNG
(US11555009, Compound 15 | US11555009, Compound 29)
Show SMILES Cc1noc(C)c1-c1cc(Cl)c(Nc2ccccc2C(O)=O)c(Cl)c1
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Citation and Details
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50599021
PNG
(CHEMBL5195767)
Show SMILES C(NCC1(COC1)N1CCCC1)c1ccc(o1)-c1ccccc1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c02075
BindingDB Entry DOI: 10.7270/Q29C72GZ
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM624871
PNG
(US20230322715, Compound TR-FTO-35)
Show SMILES C(NCC1(COC1)N1CCCC1)C1CCC(O1)c1ccccc1
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TBA



Citation and Details
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50606681
PNG
(CHEMBL5219846)
Show SMILES OC(=O)CNC(=O)c1nc(Nc2ccc(cc2)[N+]([O-])=O)ccc1O
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TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01204
BindingDB Entry DOI: 10.7270/Q2BR8X83
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50596052
PNG
(CHEMBL5196484)
Show SMILES Cc1c(Nc2ccncc2C(=O)NNC(=O)\C=C\C(O)=O)cc(Cl)c(Nc2ccccc2[N+]([O-])=O)c1Cl
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01107
BindingDB Entry DOI: 10.7270/Q2QF8XWG
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50599012
PNG
(CHEMBL5200892 | US20230322715, Compound TR-FTO-11)
Show SMILES Fc1ccc2[nH]cc(CNCC3(COC3)N3CCCC3)c2c1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c02075
BindingDB Entry DOI: 10.7270/Q29C72GZ
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50599012
PNG
(CHEMBL5200892 | US20230322715, Compound TR-FTO-11)
Show SMILES Fc1ccc2[nH]cc(CNCC3(COC3)N3CCCC3)c2c1
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TBA



Citation and Details
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50599025
PNG
(CHEMBL5207866 | US20230322715, Compound TR-FTO-40)
Show SMILES FC(F)(F)Sc1ccc(CNCC2(COC2)N2CCCC2)cc1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c02075
BindingDB Entry DOI: 10.7270/Q29C72GZ
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50599025
PNG
(CHEMBL5207866 | US20230322715, Compound TR-FTO-40)
Show SMILES FC(F)(F)Sc1ccc(CNCC2(COC2)N2CCCC2)cc1
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TBA



Citation and Details
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50594333
PNG
(CHEMBL5174419)
Show SMILES Cc1n[nH]cc1-c1cc(Cl)c(Nc2ccccc2C(O)=O)c(Cl)c1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00848
BindingDB Entry DOI: 10.7270/Q2959NJK
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50599023
PNG
(CHEMBL5194680)
Show SMILES C(NCC1(COC1)N1CCCC1)c1ccc(s1)-c1ccccc1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c02075
BindingDB Entry DOI: 10.7270/Q29C72GZ
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM624873
PNG
(US20230322715, Compound TR-FTO-38)
Show SMILES C(NCC1(COC1)N1CCCC1)C1CCC(S1)c1ccccc1
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Citation and Details
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50606682
PNG
(CHEMBL5220094)
Show SMILES OC(=O)CNC(=O)c1nc(Nc2ccc(cn2)[N+]([O-])=O)ccc1O
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01204
BindingDB Entry DOI: 10.7270/Q2BR8X83
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50485565
PNG
(CHEMBL465179)
Show SMILES CN(C)c1nc(N)c(nc1Cl)C(=O)NC(N)=N
Show InChI InChI=1S/C8H12ClN7O/c1-16(2)6-4(9)13-3(5(10)14-6)7(17)15-8(11)12/h1-2H3,(H2,10,14)(H4,11,12,15,17)
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Citation and Details
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50599019
PNG
(CHEMBL5207797 | US20230322715, Compound TR-FTO-30)
Show SMILES Cc1ccc(CNCC2(COC2)N2CCCC2)cc1C
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More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50599011
PNG
(CHEMBL5204291 | US20230322715, Compound TR-FTO-09)
Show SMILES Cc1ccc2[nH]cc(CNCC3(COC3)N3CCCC3)c2c1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c02075
BindingDB Entry DOI: 10.7270/Q29C72GZ
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50599019
PNG
(CHEMBL5207797 | US20230322715, Compound TR-FTO-30)
Show SMILES Cc1ccc(CNCC2(COC2)N2CCCC2)cc1C
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c02075
BindingDB Entry DOI: 10.7270/Q29C72GZ
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50599011
PNG
(CHEMBL5204291 | US20230322715, Compound TR-FTO-09)
Show SMILES Cc1ccc2[nH]cc(CNCC3(COC3)N3CCCC3)c2c1
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TBA



Citation and Details
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM589238
PNG
(US11555009, Compound 26)
Show SMILES Cc1noc(C)c1-c1cc(Cl)c(Nc2ccccc2-c2nn[nH]n2)c(Cl)c1
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Assay Description
The present invention provides a novel class of demethylase FTO inhibitors which inhibit FTO protein activity at very low concentration (typically IC...


Citation and Details

BindingDB Entry DOI: 10.7270/Q22B92ZG
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM589235
PNG
(US11555009, Compound 15 | US11555009, Compound 29)
Show SMILES Cc1noc(C)c1-c1cc(Cl)c(Nc2ccccc2C(O)=O)c(Cl)c1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00848
BindingDB Entry DOI: 10.7270/Q2959NJK
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50606686
PNG
(CHEMBL5219336)
Show SMILES CNC(=O)c1ccc(Nc2ccc(O)c(n2)C(=O)NCC(O)=O)cc1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01204
BindingDB Entry DOI: 10.7270/Q2BR8X83
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50599029
PNG
(CHEMBL5203668)
Show SMILES FC1CCN(C1)C1(CNCc2c[nH]c3cc(F)ccc23)COC1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c02075
BindingDB Entry DOI: 10.7270/Q29C72GZ
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50599013
PNG
(CHEMBL5199622 | US20230322715, Compound TR-FTO-44)
Show SMILES Fc1ccc2c(CNCC3(COC3)N3CCCC3)c[nH]c2c1
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Citation and Details
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM85848
PNG
(CAS_172307 | Fiduxosin | NSC_172307)
Show SMILES COc1cccc2OCC3CN(CCCCn4c(=O)[nH]c5c6nc(cnc6sc5c4=O)-c4ccccc4)CC3c12
Show InChI InChI=1S/C30H29N5O4S/c1-38-22-10-7-11-23-24(22)20-16-34(15-19(20)17-39-23)12-5-6-13-35-29(36)27-25(33-30(35)37)26-28(40-27)31-14-21(32-26)18-8-3-2-4-9-18/h2-4,7-11,14,19-20H,5-6,12-13,15-17H2,1H3,(H,33,37)
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Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
CHEMBL4461072
PNG
Show SMILES O=C(NC1CCCCC1)c1cnc2ccccc2n1
Show InChI InChI=1S/C15H17N3O/c19-15(17-11-6-2-1-3-7-11)14-10-16-12-8-4-5-9-13(12)18-14/h4-5,8-11H,1-3,6-7H2,(H,17,19)
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Citation and Details
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Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM589236
PNG
(US11555009, Compound 17)
Show SMILES Cc1n[nH]c(C)c1-c1cc(Cl)c(Nc2ccccc2C(O)=O)c(Cl)c1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00848
BindingDB Entry DOI: 10.7270/Q2959NJK
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50596051
PNG
(CHEMBL5183243)
Show SMILES OC(=O)\C=C\C(=O)NNC(=O)c1cnccc1Nc1cc(Cl)c(Nc2ccccc2[N+]([O-])=O)c(Cl)c1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01107
BindingDB Entry DOI: 10.7270/Q2QF8XWG
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50594336
PNG
(CHEMBL5176527)
Show SMILES OC(=O)c1ccccc1Nc1c(Cl)cc(cc1Cl)-c1c[nH]nn1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00848
BindingDB Entry DOI: 10.7270/Q2959NJK
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50599018
PNG
(CHEMBL5186890 | US20230322715, Compound TR-FTO-27)
Show SMILES C(NCC1(COC1)N1CCCC1)c1ccc2OCCOc2c1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c02075
BindingDB Entry DOI: 10.7270/Q29C72GZ
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50599018
PNG
(CHEMBL5186890 | US20230322715, Compound TR-FTO-27)
Show SMILES C(NCC1(COC1)N1CCCC1)c1ccc2OCCOc2c1
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Citation and Details
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Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
CHEMBL4435048
PNG
Show SMILES CCOc1nc2ccccc2nc1C(=O)NCCN(CC)CC
Show InChI InChI=1S/C17H24N4O2/c1-4-21(5-2)12-11-18-16(22)15-17(23-6-3)20-14-10-8-7-9-13(14)19-15/h7-10H,4-6,11-12H2,1-3H3,(H,18,22)
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Citation and Details
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50594337
PNG
(CHEMBL5176730)
Show SMILES Cc1noc(C)c1-c1cc(F)c(Nc2ccccc2C(O)=O)c(Cl)c1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00848
BindingDB Entry DOI: 10.7270/Q2959NJK
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM477000
PNG
(US11555009, Compound 1)
Show SMILES Cn1cc(-c2cc(-c3cc(Cl)cc(OCc4ocnc4C(F)(F)F)c3)c(=O)n(c2)-c2cccnc2)c(=O)[nH]c1=O
Show InChI InChI=1S/C26H17ClF3N5O5/c1-34-11-20(23(36)33-25(34)38)15-7-19(24(37)35(10-15)17-3-2-4-31-9-17)14-5-16(27)8-18(6-14)39-12-21-22(26(28,29)30)32-13-40-21/h2-11,13H,12H2,1H3,(H,33,36,38)
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n/an/a 700n/an/an/an/an/an/a


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Assay Description
The present invention provides a novel class of demethylase FTO inhibitors which inhibit FTO protein activity at very low concentration (typically IC...


Citation and Details

BindingDB Entry DOI: 10.7270/Q22B92ZG
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
CHEMBL5268705
PNG
Show SMILES CCOc1nc2ccccc2nc1C(=O)Nc1cccnc1
Show InChI InChI=1S/C16H14N4O2/c1-2-22-16-14(15(21)18-11-6-5-9-17-10-11)19-12-7-3-4-8-13(12)20-16/h3-10H,2H2,1H3,(H,18,21)
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n/an/a 750n/an/an/an/an/an/a


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Citation and Details
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50606684
PNG
(CHEMBL5220148)
Show SMILES Nc1ccc(Nc2ccc(O)c(n2)C(=O)NCC(O)=O)nc1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01204
BindingDB Entry DOI: 10.7270/Q2BR8X83
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50599022
PNG
(CHEMBL5181285 | US20230322715, Compound TR-FTO-37)
Show SMILES C(NCC1(COC1)N1CCCC1)c1ccc2[nH]ccc2c1
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Citation and Details
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50596053
PNG
(CHEMBL5173876)
Show SMILES OC(=O)\C=C\C(=O)NNC(=O)c1cnccc1Cc1ccccc1
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Citation and Details
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50599022
PNG
(CHEMBL5181285 | US20230322715, Compound TR-FTO-37)
Show SMILES C(NCC1(COC1)N1CCCC1)c1ccc2[nH]ccc2c1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c02075
BindingDB Entry DOI: 10.7270/Q29C72GZ
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50599013
PNG
(CHEMBL5199622 | US20230322715, Compound TR-FTO-44)
Show SMILES Fc1ccc2c(CNCC3(COC3)N3CCCC3)c[nH]c2c1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c02075
BindingDB Entry DOI: 10.7270/Q29C72GZ
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50599013
PNG
(CHEMBL5199622 | US20230322715, Compound TR-FTO-44)
Show SMILES Fc1ccc2c(CNCC3(COC3)N3CCCC3)c[nH]c2c1
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Citation and Details
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50017226
PNG
((R)-2-Amino-7-phosphono-heptanoic acid | 2-Amino-7...)
Show SMILES N[C@H](CCCCCP(O)(O)=O)C(O)=O
Show InChI InChI=1S/C7H16NO5P/c8-6(7(9)10)4-2-1-3-5-14(11,12)13/h6H,1-5,8H2,(H,9,10)(H2,11,12,13)/t6-/m1/s1
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Citation and Details
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50599015
PNG
(CHEMBL5177222 | US20230322715, Compound TR-FTO-14)
Show SMILES COc1cccc2c(CNCC3(COC3)N3CCCC3)c[nH]c12
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c02075
BindingDB Entry DOI: 10.7270/Q29C72GZ
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50599015
PNG
(CHEMBL5177222 | US20230322715, Compound TR-FTO-14)
Show SMILES COc1cccc2c(CNCC3(COC3)N3CCCC3)c[nH]c12
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Citation and Details
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50594335
PNG
(CHEMBL4436398)
Show SMILES OC(=O)c1ccccc1Nc1c(Cl)cc(cc1Cl)-c1nnn[nH]1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00848
BindingDB Entry DOI: 10.7270/Q2959NJK
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50599030
PNG
(CHEMBL5182180 | US20230322715, Compound TR-FTO-45)
Show SMILES FC1CCN(C1)C1(CNCc2c[nH]c3ccc(F)cc23)COC1
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Citation and Details
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50594341
PNG
(CHEMBL5173835)
Show SMILES Cc1noc(C)c1-c1cc(Cl)c(Nc2ccccc2C(O)=O)c(Cl)n1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00848
BindingDB Entry DOI: 10.7270/Q2959NJK
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50606685
PNG
(CHEMBL5219099)
Show SMILES COC(=O)c1ccc(Nc2ccc(O)c(n2)C(=O)NCC(O)=O)cc1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01204
BindingDB Entry DOI: 10.7270/Q2BR8X83
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50599030
PNG
(CHEMBL5182180 | US20230322715, Compound TR-FTO-45)
Show SMILES FC1CCN(C1)C1(CNCc2c[nH]c3ccc(F)cc23)COC1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c02075
BindingDB Entry DOI: 10.7270/Q29C72GZ
More data for this
Ligand-Target Pair
Alpha-ketoglutarate-dependent dioxygenase FTO


(Homo sapiens (Human))
BDBM50594340
PNG
(CHEMBL5171501)
Show SMILES Cc1noc(C)c1-c1cc(C)c(Nc2ccccc2C(O)=O)c(Cl)c1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00848
BindingDB Entry DOI: 10.7270/Q2959NJK
More data for this
Ligand-Target Pair
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