Found 86 hits with Last Name = 'subashi' and Initial = 't' Target/Host (Institution) | Ligand | Target/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 | pH | Temp °C |
Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase
(Homo sapiens (Human)) | BDBM50117662
![PNG](/data/jpeg/tenK5011/BindingDB_50117662.png) (CHEMBL3613706)Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(n2)-c2ccccc2)c1 Show InChI InChI=1S/C25H23N5O4S/c1-34-22-9-5-6-18(12-22)13-25(31)29-16-19-10-11-23(14-20(19)17-29)35(32,33)28-24-15-26-30(27-24)21-7-3-2-4-8-21/h2-12,14-15H,13,16-17H2,1H3,(H,27,28) | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of MGAT3 (unknown origin) assessed effect on incorporation of [1-14C]decanoyl moiety into triacylglycerol using [1-14C]decanoyl-CoA and 1,... |
J Med Chem 58: 7164-72 (2015)
Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ |
More data for this Ligand-Target Pair | |
Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase
(Homo sapiens (Human)) | BDBM50117663
![PNG](/data/jpeg/tenK5011/BindingDB_50117663.png) (CHEMBL3613707)Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(n2)-c2ccc(F)cc2)c1 Show InChI InChI=1S/C25H22FN5O4S/c1-35-22-4-2-3-17(11-22)12-25(32)30-15-18-5-10-23(13-19(18)16-30)36(33,34)29-24-14-27-31(28-24)21-8-6-20(26)7-9-21/h2-11,13-14H,12,15-16H2,1H3,(H,28,29) | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of MGAT3 (unknown origin) assessed effect on incorporation of [1-14C]decanoyl moiety into triacylglycerol using [1-14C]decanoyl-CoA and 1,... |
J Med Chem 58: 7164-72 (2015)
Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ |
More data for this Ligand-Target Pair | |
Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase
(Homo sapiens (Human)) | BDBM50117663
![PNG](/data/jpeg/tenK5011/BindingDB_50117663.png) (CHEMBL3613707)Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(n2)-c2ccc(F)cc2)c1 Show InChI InChI=1S/C25H22FN5O4S/c1-35-22-4-2-3-17(11-22)12-25(32)30-15-18-5-10-23(13-19(18)16-30)36(33,34)29-24-14-27-31(28-24)21-8-6-20(26)7-9-21/h2-11,13-14H,12,15-16H2,1H3,(H,28,29) | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 6.30 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of MGAT3 (unknown origin) assessed effect on incorporation of [1-14C]decanoyl moiety into triacylglycerol using [1-14C]decanoyl-CoA and 1,... |
J Med Chem 58: 7164-72 (2015)
Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ |
More data for this Ligand-Target Pair | |
Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase
(Homo sapiens (Human)) | BDBM50117662
![PNG](/data/jpeg/tenK5011/BindingDB_50117662.png) (CHEMBL3613706)Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(n2)-c2ccccc2)c1 Show InChI InChI=1S/C25H23N5O4S/c1-34-22-9-5-6-18(12-22)13-25(31)29-16-19-10-11-23(14-20(19)17-29)35(32,33)28-24-15-26-30(27-24)21-7-3-2-4-8-21/h2-12,14-15H,13,16-17H2,1H3,(H,27,28) | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 6.30 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of MGAT3 (unknown origin) assessed effect on incorporation of [1-14C]decanoyl moiety into triacylglycerol using [1-14C]decanoyl-CoA and 1,... |
J Med Chem 58: 7164-72 (2015)
Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ |
More data for this Ligand-Target Pair | |
Ketohexokinase
(Homo sapiens (Human)) | BDBM50380246
![PNG](/data/jpeg/tenK5038/BindingDB_50380246.png) (CHEMBL2017214)Show SMILES CSc1ccccc1Nc1nc(nc2c(NCC3CC3)ncnc12)N1CCNCC1 Show InChI InChI=1S/C21H26N8S/c1-30-16-5-3-2-4-15(16)26-20-17-18(19(25-13-24-17)23-12-14-6-7-14)27-21(28-20)29-10-8-22-9-11-29/h2-5,13-14,22H,6-12H2,1H3,(H,23,24,25)(H,26,27,28) | PDB
UniProtKB/SwissProt
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Similars
| PDB Article PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of KHK (unknown origin) using D-fructose as substrate after 60 mins in presence of ATP by LC-MS analysis |
J Med Chem 60: 7835-7849 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00947 BindingDB Entry DOI: 10.7270/Q2H997CM |
More data for this Ligand-Target Pair | ![3D 3D](/images/Docked_3d.png) 3D Structure (crystal) |
Cyclic GMP-AMP synthase
(Homo sapiens) | BDBM17051
![PNG](/data/jpeg/tenK1/BindingDB_17051.png) (BX-795 | BX-795, 3 | N-(3-{[5-iodo-4-({3-[(thiophe...)Show SMILES Ic1cnc(Nc2cccc(NC(=O)N3CCCC3)c2)nc1NCCCNC(=O)c1cccs1 Show InChI InChI=1S/C23H26IN7O2S/c24-18-15-27-22(30-20(18)25-9-5-10-26-21(32)19-8-4-13-34-19)28-16-6-3-7-17(14-16)29-23(33)31-11-1-2-12-31/h3-4,6-8,13-15H,1-2,5,9-12H2,(H,26,32)(H,29,33)(H2,25,27,28,30) | PDB
UniProtKB/SwissProt
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Patents
Similars
| Article PubMed
| n/a | n/a | 60 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of cGAS in human THP1 cells assessed as reduction in salmon sperm dsDNA-induced IFN-beta expression preincubated for 1 hr followed by dsDN... |
PLoS ONE 12: (2017)
Article DOI: 10.1371/journal.pone.0184843 BindingDB Entry DOI: 10.7270/Q2WQ067J |
More data for this Ligand-Target Pair | |
Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase
(Homo sapiens (Human)) | BDBM50117668
![PNG](/data/jpeg/tenK5011/BindingDB_50117668.png) (CHEMBL3613712)Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(n2)C2CC(F)(F)C2)c1 Show InChI InChI=1S/C23H23F2N5O4S/c1-34-19-4-2-3-15(7-19)8-22(31)29-13-16-5-6-20(9-17(16)14-29)35(32,33)28-21-12-26-30(27-21)18-10-23(24,25)11-18/h2-7,9,12,18H,8,10-11,13-14H2,1H3,(H,27,28) | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 63 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of MGAT3 (unknown origin) assessed effect on incorporation of [1-14C]decanoyl moiety into triacylglycerol using [1-14C]decanoyl-CoA and 1,... |
J Med Chem 58: 7164-72 (2015)
Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ |
More data for this Ligand-Target Pair | |
Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase
(Homo sapiens (Human)) | BDBM50117668
![PNG](/data/jpeg/tenK5011/BindingDB_50117668.png) (CHEMBL3613712)Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(n2)C2CC(F)(F)C2)c1 Show InChI InChI=1S/C23H23F2N5O4S/c1-34-19-4-2-3-15(7-19)8-22(31)29-13-16-5-6-20(9-17(16)14-29)35(32,33)28-21-12-26-30(27-21)18-10-23(24,25)11-18/h2-7,9,12,18H,8,10-11,13-14H2,1H3,(H,27,28) | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 63 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of MGAT3 (unknown origin) assessed effect on incorporation of [1-14C]decanoyl moiety into triacylglycerol using [1-14C]decanoyl-CoA and 1,... |
J Med Chem 58: 7164-72 (2015)
Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ |
More data for this Ligand-Target Pair | |
Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase
(Homo sapiens (Human)) | BDBM50117667
![PNG](/data/jpeg/tenK5011/BindingDB_50117667.png) (CHEMBL3613711)Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(n2)C2CCCOC2)c1 Show InChI InChI=1S/C24H27N5O5S/c1-33-21-6-2-4-17(10-21)11-24(30)28-14-18-7-8-22(12-19(18)15-28)35(31,32)27-23-13-25-29(26-23)20-5-3-9-34-16-20/h2,4,6-8,10,12-13,20H,3,5,9,11,14-16H2,1H3,(H,26,27) | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 72 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of MGAT3 (unknown origin) assessed effect on incorporation of [1-14C]decanoyl moiety into triacylglycerol using [1-14C]decanoyl-CoA and 1,... |
J Med Chem 58: 7164-72 (2015)
Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ |
More data for this Ligand-Target Pair | |
Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase
(Homo sapiens (Human)) | BDBM50117667
![PNG](/data/jpeg/tenK5011/BindingDB_50117667.png) (CHEMBL3613711)Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(n2)C2CCCOC2)c1 Show InChI InChI=1S/C24H27N5O5S/c1-33-21-6-2-4-17(10-21)11-24(30)28-14-18-7-8-22(12-19(18)15-28)35(31,32)27-23-13-25-29(26-23)20-5-3-9-34-16-20/h2,4,6-8,10,12-13,20H,3,5,9,11,14-16H2,1H3,(H,26,27) | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 79 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of MGAT3 (unknown origin) assessed effect on incorporation of [1-14C]decanoyl moiety into triacylglycerol using [1-14C]decanoyl-CoA and 1,... |
J Med Chem 58: 7164-72 (2015)
Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ |
More data for this Ligand-Target Pair | |
Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase
(Homo sapiens (Human)) | BDBM50117665
![PNG](/data/jpeg/tenK5011/BindingDB_50117665.png) (CHEMBL3613709)Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(n2)C2CCC2)c1 Show InChI InChI=1S/C23H25N5O4S/c1-32-20-7-2-4-16(10-20)11-23(29)27-14-17-8-9-21(12-18(17)15-27)33(30,31)26-22-13-24-28(25-22)19-5-3-6-19/h2,4,7-10,12-13,19H,3,5-6,11,14-15H2,1H3,(H,25,26) | Reactome pathway KEGG
UniProtKB/SwissProt
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CHEMBL MCE PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 92 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of MGAT3 (unknown origin) assessed effect on incorporation of [1-14C]decanoyl moiety into triacylglycerol using [1-14C]decanoyl-CoA and 1,... |
J Med Chem 58: 7164-72 (2015)
Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ |
More data for this Ligand-Target Pair | |
Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase
(Homo sapiens (Human)) | BDBM50117665
![PNG](/data/jpeg/tenK5011/BindingDB_50117665.png) (CHEMBL3613709)Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(n2)C2CCC2)c1 Show InChI InChI=1S/C23H25N5O4S/c1-32-20-7-2-4-16(10-20)11-23(29)27-14-17-8-9-21(12-18(17)15-27)33(30,31)26-22-13-24-28(25-22)19-5-3-6-19/h2,4,7-10,12-13,19H,3,5-6,11,14-15H2,1H3,(H,25,26) | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
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Similars
| Article PubMed
| n/a | n/a | 100 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of MGAT3 (unknown origin) assessed effect on incorporation of [1-14C]decanoyl moiety into triacylglycerol using [1-14C]decanoyl-CoA and 1,... |
J Med Chem 58: 7164-72 (2015)
Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ |
More data for this Ligand-Target Pair | |
Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase
(Homo sapiens (Human)) | BDBM50117665
![PNG](/data/jpeg/tenK5011/BindingDB_50117665.png) (CHEMBL3613709)Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(n2)C2CCC2)c1 Show InChI InChI=1S/C23H25N5O4S/c1-32-20-7-2-4-16(10-20)11-23(29)27-14-17-8-9-21(12-18(17)15-27)33(30,31)26-22-13-24-28(25-22)19-5-3-6-19/h2,4,7-10,12-13,19H,3,5-6,11,14-15H2,1H3,(H,25,26) | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
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CHEMBL MCE PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 204 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of human MGAT3 expressed in HEK293 cells assessed as effect on incorporation of [1,3-14C] glycerol into TAG by TLC method in presence of D... |
J Med Chem 58: 7164-72 (2015)
Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ |
More data for this Ligand-Target Pair | |
Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase
(Homo sapiens (Human)) | BDBM50117665
![PNG](/data/jpeg/tenK5011/BindingDB_50117665.png) (CHEMBL3613709)Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(n2)C2CCC2)c1 Show InChI InChI=1S/C23H25N5O4S/c1-32-20-7-2-4-16(10-20)11-23(29)27-14-17-8-9-21(12-18(17)15-27)33(30,31)26-22-13-24-28(25-22)19-5-3-6-19/h2,4,7-10,12-13,19H,3,5-6,11,14-15H2,1H3,(H,25,26) | Reactome pathway KEGG
UniProtKB/SwissProt
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Similars
| Article PubMed
| n/a | n/a | 205 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of human MGAT3 expressed in HEK293 cells assessed as effect on incorporation of [1,3-14C] glycerol into TAG by TLC method in presence of D... |
J Med Chem 58: 7164-72 (2015)
Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ |
More data for this Ligand-Target Pair | |
Ketohexokinase
(Rattus norvegicus) | BDBM50241178
![PNG](/data/jpeg/tenK5024/BindingDB_50241178.png) (CHEMBL4070442)Show SMILES C[C@]1(O)CCN(C1)c1nc(cc(c1C#N)C(F)(F)F)N1C[C@H](O)[C@@H](O)C1 |r| Show InChI InChI=1S/C16H19F3N4O3/c1-15(26)2-3-22(8-15)14-9(5-20)10(16(17,18)19)4-13(21-14)23-6-11(24)12(25)7-23/h4,11-12,24-26H,2-3,6-8H2,1H3/t11-,12-,15-/m0/s1 | PDB
UniProtKB/SwissProt
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| PDB Article PubMed
| n/a | n/a | 340 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of recombinant rat N-terminal His-tagged KHK expressed in Escherichia coli BL21(DE3) using fructose as substrate incubated for 30 mins fol... |
J Med Chem 60: 7835-7849 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00947 BindingDB Entry DOI: 10.7270/Q2H997CM |
More data for this Ligand-Target Pair | ![3D 3D](/images/Docked_3d.png) 3D Structure (crystal) |
Ketohexokinase
(Rattus norvegicus) | BDBM50241178
![PNG](/data/jpeg/tenK5024/BindingDB_50241178.png) (CHEMBL4070442)Show SMILES C[C@]1(O)CCN(C1)c1nc(cc(c1C#N)C(F)(F)F)N1C[C@H](O)[C@@H](O)C1 |r| Show InChI InChI=1S/C16H19F3N4O3/c1-15(26)2-3-22(8-15)14-9(5-20)10(16(17,18)19)4-13(21-14)23-6-11(24)12(25)7-23/h4,11-12,24-26H,2-3,6-8H2,1H3/t11-,12-,15-/m0/s1 | PDB
UniProtKB/SwissProt
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Similars
| PDB Article PubMed
| n/a | n/a | 340 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of recombinant rat N-terminal His-tagged KHK expressed in Escherichia coli BL21(DE3) using fructose as substrate incubated for 30 mins fol... |
J Med Chem 60: 7835-7849 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00947 BindingDB Entry DOI: 10.7270/Q2H997CM |
More data for this Ligand-Target Pair | ![3D 3D](/images/Docked_3d.png) 3D Structure (crystal) |
Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase
(Homo sapiens (Human)) | BDBM50117666
![PNG](/data/jpeg/tenK5011/BindingDB_50117666.png) (CHEMBL3613710)Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(n2)C2COC2)c1 Show InChI InChI=1S/C22H23N5O5S/c1-31-19-4-2-3-15(7-19)8-22(28)26-11-16-5-6-20(9-17(16)12-26)33(29,30)25-21-10-23-27(24-21)18-13-32-14-18/h2-7,9-10,18H,8,11-14H2,1H3,(H,24,25) | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
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Similars
| Article PubMed
| n/a | n/a | 365 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of MGAT3 (unknown origin) assessed effect on incorporation of [1-14C]decanoyl moiety into triacylglycerol using [1-14C]decanoyl-CoA and 1,... |
J Med Chem 58: 7164-72 (2015)
Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ |
More data for this Ligand-Target Pair | |
Ketohexokinase
(Homo sapiens (Human)) | BDBM50241178
![PNG](/data/jpeg/tenK5024/BindingDB_50241178.png) (CHEMBL4070442)Show SMILES C[C@]1(O)CCN(C1)c1nc(cc(c1C#N)C(F)(F)F)N1C[C@H](O)[C@@H](O)C1 |r| Show InChI InChI=1S/C16H19F3N4O3/c1-15(26)2-3-22(8-15)14-9(5-20)10(16(17,18)19)4-13(21-14)23-6-11(24)12(25)7-23/h4,11-12,24-26H,2-3,6-8H2,1H3/t11-,12-,15-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
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| PDB Article PubMed
| n/a | n/a | 389 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of recombinant human N-terminal His-tagged KHK-A expressed in Escherichia coli BL21(DE3) using fructose as substrate incubated for 30 mins... |
J Med Chem 60: 7835-7849 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00947 BindingDB Entry DOI: 10.7270/Q2H997CM |
More data for this Ligand-Target Pair | ![3D 3D](/images/Docked_3d.png) 3D Structure (crystal) |
Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase
(Homo sapiens (Human)) | BDBM50117668
![PNG](/data/jpeg/tenK5011/BindingDB_50117668.png) (CHEMBL3613712)Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(n2)C2CC(F)(F)C2)c1 Show InChI InChI=1S/C23H23F2N5O4S/c1-34-19-4-2-3-15(7-19)8-22(31)29-13-16-5-6-20(9-17(16)14-29)35(32,33)28-21-12-26-30(27-21)18-10-23(24,25)11-18/h2-7,9,12,18H,8,10-11,13-14H2,1H3,(H,27,28) | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
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Similars
| Article PubMed
| n/a | n/a | 389 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of human MGAT3 expressed in HEK293 cells assessed as effect on incorporation of [1,3-14C] glycerol into TAG by TLC method in presence of D... |
J Med Chem 58: 7164-72 (2015)
Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ |
More data for this Ligand-Target Pair | |
Ketohexokinase
(Homo sapiens (Human)) | BDBM50241178
![PNG](/data/jpeg/tenK5024/BindingDB_50241178.png) (CHEMBL4070442)Show SMILES C[C@]1(O)CCN(C1)c1nc(cc(c1C#N)C(F)(F)F)N1C[C@H](O)[C@@H](O)C1 |r| Show InChI InChI=1S/C16H19F3N4O3/c1-15(26)2-3-22(8-15)14-9(5-20)10(16(17,18)19)4-13(21-14)23-6-11(24)12(25)7-23/h4,11-12,24-26H,2-3,6-8H2,1H3/t11-,12-,15-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
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CHEMBL MCE PC cid PC sid PDB UniChem
Similars
| PDB Article PubMed
| n/a | n/a | 390 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of recombinant human N-terminal His-tagged KHK-A expressed in Escherichia coli BL21(DE3) using fructose as substrate incubated for 30 mins... |
J Med Chem 60: 7835-7849 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00947 BindingDB Entry DOI: 10.7270/Q2H997CM |
More data for this Ligand-Target Pair | ![3D 3D](/images/Docked_3d.png) 3D Structure (crystal) |
Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase
(Homo sapiens (Human)) | BDBM50117668
![PNG](/data/jpeg/tenK5011/BindingDB_50117668.png) (CHEMBL3613712)Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(n2)C2CC(F)(F)C2)c1 Show InChI InChI=1S/C23H23F2N5O4S/c1-34-19-4-2-3-15(7-19)8-22(31)29-13-16-5-6-20(9-17(16)14-29)35(32,33)28-21-12-26-30(27-21)18-10-23(24,25)11-18/h2-7,9,12,18H,8,10-11,13-14H2,1H3,(H,27,28) | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 394 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of human MGAT3 expressed in HEK293 cells assessed as effect on incorporation of [1,3-14C] glycerol into TAG by TLC method in presence of D... |
J Med Chem 58: 7164-72 (2015)
Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ |
More data for this Ligand-Target Pair | |
Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase
(Homo sapiens (Human)) | BDBM50117666
![PNG](/data/jpeg/tenK5011/BindingDB_50117666.png) (CHEMBL3613710)Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(n2)C2COC2)c1 Show InChI InChI=1S/C22H23N5O5S/c1-31-19-4-2-3-15(7-19)8-22(28)26-11-16-5-6-20(9-17(16)12-26)33(29,30)25-21-10-23-27(24-21)18-13-32-14-18/h2-7,9-10,18H,8,11-14H2,1H3,(H,24,25) | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 398 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of MGAT3 (unknown origin) assessed effect on incorporation of [1-14C]decanoyl moiety into triacylglycerol using [1-14C]decanoyl-CoA and 1,... |
J Med Chem 58: 7164-72 (2015)
Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ |
More data for this Ligand-Target Pair | |
Ketohexokinase
(Homo sapiens (Human)) | BDBM50241178
![PNG](/data/jpeg/tenK5024/BindingDB_50241178.png) (CHEMBL4070442)Show SMILES C[C@]1(O)CCN(C1)c1nc(cc(c1C#N)C(F)(F)F)N1C[C@H](O)[C@@H](O)C1 |r| Show InChI InChI=1S/C16H19F3N4O3/c1-15(26)2-3-22(8-15)14-9(5-20)10(16(17,18)19)4-13(21-14)23-6-11(24)12(25)7-23/h4,11-12,24-26H,2-3,6-8H2,1H3/t11-,12-,15-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
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CHEMBL MCE PC cid PC sid PDB UniChem
Similars
| PDB Article PubMed
| n/a | n/a | 450 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of recombinant human N-terminal His-tagged KHK-C expressed in Escherichia coli BL21(DE3) using fructose as substrate incubated for 30 mins... |
J Med Chem 60: 7835-7849 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00947 BindingDB Entry DOI: 10.7270/Q2H997CM |
More data for this Ligand-Target Pair | ![3D 3D](/images/Docked_3d.png) 3D Structure (crystal) |
Ketohexokinase
(Homo sapiens (Human)) | BDBM50241178
![PNG](/data/jpeg/tenK5024/BindingDB_50241178.png) (CHEMBL4070442)Show SMILES C[C@]1(O)CCN(C1)c1nc(cc(c1C#N)C(F)(F)F)N1C[C@H](O)[C@@H](O)C1 |r| Show InChI InChI=1S/C16H19F3N4O3/c1-15(26)2-3-22(8-15)14-9(5-20)10(16(17,18)19)4-13(21-14)23-6-11(24)12(25)7-23/h4,11-12,24-26H,2-3,6-8H2,1H3/t11-,12-,15-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
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CHEMBL MCE PC cid PC sid PDB UniChem
Similars
| PDB Article PubMed
| n/a | n/a | 450 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of recombinant human N-terminal His-tagged KHK-C expressed in Escherichia coli BL21(DE3) using fructose as substrate incubated for 30 mins... |
J Med Chem 60: 7835-7849 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00947 BindingDB Entry DOI: 10.7270/Q2H997CM |
More data for this Ligand-Target Pair | ![3D 3D](/images/Docked_3d.png) 3D Structure (crystal) |
Ketohexokinase
(Homo sapiens (Human)) | BDBM50349755
![PNG](/data/jpeg/tenK5034/BindingDB_50349755.png) (CHEMBL1809182 | US8822447, 50 | US9771375, Example...)Show InChI InChI=1S/C21H24N4/c1-2-20-19-9-8-18(24-13-15-11-22-12-16(15)14-24)10-21(19)25(23-20)17-6-4-3-5-7-17/h3-10,15-16,22H,2,11-14H2,1H3 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid PDB UniChem
Patents
Similars
| PDB Article PubMed
| n/a | n/a | 590 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of KHK (unknown origin) using D-fructose as substrate after 60 mins in presence of ATP by LC-MS analysis |
J Med Chem 60: 7835-7849 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00947 BindingDB Entry DOI: 10.7270/Q2H997CM |
More data for this Ligand-Target Pair | ![3D 3D](/images/Docked_3d.png) 3D Structure (crystal) |
Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase
(Homo sapiens (Human)) | BDBM50117664
![PNG](/data/jpeg/tenK5011/BindingDB_50117664.png) (CHEMBL3613708)Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(n2)C(C)C)c1 Show InChI InChI=1S/C22H25N5O4S/c1-15(2)27-23-12-21(24-27)25-32(29,30)20-8-7-17-13-26(14-18(17)11-20)22(28)10-16-5-4-6-19(9-16)31-3/h4-9,11-12,15H,10,13-14H2,1-3H3,(H,24,25) | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 597 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of MGAT3 (unknown origin) assessed effect on incorporation of [1-14C]decanoyl moiety into triacylglycerol using [1-14C]decanoyl-CoA and 1,... |
J Med Chem 58: 7164-72 (2015)
Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ |
More data for this Ligand-Target Pair | |
Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase
(Homo sapiens (Human)) | BDBM50117659
![PNG](/data/jpeg/tenK5011/BindingDB_50117659.png) (CHEMBL3613703)Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)NCCc2cccc(F)c2)c1 Show InChI InChI=1S/C25H25FN2O4S/c1-32-23-7-3-5-19(13-23)14-25(29)28-16-20-8-9-24(15-21(20)17-28)33(30,31)27-11-10-18-4-2-6-22(26)12-18/h2-9,12-13,15,27H,10-11,14,16-17H2,1H3 | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 631 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of MGAT3 (unknown origin) assessed effect on incorporation of [1-14C]decanoyl moiety into triacylglycerol using [1-14C]decanoyl-CoA and 1,... |
J Med Chem 58: 7164-72 (2015)
Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ |
More data for this Ligand-Target Pair | |
Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase
(Homo sapiens (Human)) | BDBM50117664
![PNG](/data/jpeg/tenK5011/BindingDB_50117664.png) (CHEMBL3613708)Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(n2)C(C)C)c1 Show InChI InChI=1S/C22H25N5O4S/c1-15(2)27-23-12-21(24-27)25-32(29,30)20-8-7-17-13-26(14-18(17)11-20)22(28)10-16-5-4-6-19(9-16)31-3/h4-9,11-12,15H,10,13-14H2,1-3H3,(H,24,25) | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 631 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of MGAT3 (unknown origin) assessed effect on incorporation of [1-14C]decanoyl moiety into triacylglycerol using [1-14C]decanoyl-CoA and 1,... |
J Med Chem 58: 7164-72 (2015)
Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ |
More data for this Ligand-Target Pair | |
Ketohexokinase
(Rattus norvegicus) | BDBM50241195
![PNG](/data/jpeg/tenK5024/BindingDB_50241195.png) (CHEMBL4063606)Show SMILES C[C@]1(O)CCN(C1)c1c(C#N)c(nc2cc[nH]c12)C(F)(F)F |r| Show InChI InChI=1S/C14H13F3N4O/c1-13(22)3-5-21(7-13)11-8(6-18)12(14(15,16)17)20-9-2-4-19-10(9)11/h2,4,19,22H,3,5,7H2,1H3/t13-/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 640 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of recombinant rat N-terminal His-tagged KHK expressed in Escherichia coli BL21(DE3) using fructose as substrate incubated for 30 mins fol... |
J Med Chem 60: 7835-7849 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00947 BindingDB Entry DOI: 10.7270/Q2H997CM |
More data for this Ligand-Target Pair | |
Ketohexokinase
(Rattus norvegicus) | BDBM50241195
![PNG](/data/jpeg/tenK5024/BindingDB_50241195.png) (CHEMBL4063606)Show SMILES C[C@]1(O)CCN(C1)c1c(C#N)c(nc2cc[nH]c12)C(F)(F)F |r| Show InChI InChI=1S/C14H13F3N4O/c1-13(22)3-5-21(7-13)11-8(6-18)12(14(15,16)17)20-9-2-4-19-10(9)11/h2,4,19,22H,3,5,7H2,1H3/t13-/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 646 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of recombinant rat N-terminal His-tagged KHK expressed in Escherichia coli BL21(DE3) using fructose as substrate incubated for 30 mins fol... |
J Med Chem 60: 7835-7849 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00947 BindingDB Entry DOI: 10.7270/Q2H997CM |
More data for this Ligand-Target Pair | |
Ketohexokinase
(Homo sapiens (Human)) | BDBM50241195
![PNG](/data/jpeg/tenK5024/BindingDB_50241195.png) (CHEMBL4063606)Show SMILES C[C@]1(O)CCN(C1)c1c(C#N)c(nc2cc[nH]c12)C(F)(F)F |r| Show InChI InChI=1S/C14H13F3N4O/c1-13(22)3-5-21(7-13)11-8(6-18)12(14(15,16)17)20-9-2-4-19-10(9)11/h2,4,19,22H,3,5,7H2,1H3/t13-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 670 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of recombinant human N-terminal His-tagged KHK expressed in Escherichia coli BL21(DE3) using fructose as substrate incubated for 30 mins f... |
J Med Chem 60: 7835-7849 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00947 BindingDB Entry DOI: 10.7270/Q2H997CM |
More data for this Ligand-Target Pair | |
Ketohexokinase
(Homo sapiens (Human)) | BDBM50241195
![PNG](/data/jpeg/tenK5024/BindingDB_50241195.png) (CHEMBL4063606)Show SMILES C[C@]1(O)CCN(C1)c1c(C#N)c(nc2cc[nH]c12)C(F)(F)F |r| Show InChI InChI=1S/C14H13F3N4O/c1-13(22)3-5-21(7-13)11-8(6-18)12(14(15,16)17)20-9-2-4-19-10(9)11/h2,4,19,22H,3,5,7H2,1H3/t13-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 676 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of recombinant human N-terminal His-tagged KHK expressed in Escherichia coli BL21(DE3) using fructose as substrate incubated for 30 mins f... |
J Med Chem 60: 7835-7849 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00947 BindingDB Entry DOI: 10.7270/Q2H997CM |
More data for this Ligand-Target Pair | |
Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase
(Homo sapiens (Human)) | BDBM50117659
![PNG](/data/jpeg/tenK5011/BindingDB_50117659.png) (CHEMBL3613703)Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)NCCc2cccc(F)c2)c1 Show InChI InChI=1S/C25H25FN2O4S/c1-32-23-7-3-5-19(13-23)14-25(29)28-16-20-8-9-24(15-21(20)17-28)33(30,31)27-11-10-18-4-2-6-22(26)12-18/h2-9,12-13,15,27H,10-11,14,16-17H2,1H3 | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 682 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of MGAT3 (unknown origin) assessed effect on incorporation of [1-14C]decanoyl moiety into triacylglycerol using [1-14C]decanoyl-CoA and 1,... |
J Med Chem 58: 7164-72 (2015)
Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ |
More data for this Ligand-Target Pair | |
Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase
(Homo sapiens (Human)) | BDBM50117667
![PNG](/data/jpeg/tenK5011/BindingDB_50117667.png) (CHEMBL3613711)Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(n2)C2CCCOC2)c1 Show InChI InChI=1S/C24H27N5O5S/c1-33-21-6-2-4-17(10-21)11-24(30)28-14-18-7-8-22(12-19(18)15-28)35(31,32)27-23-13-25-29(26-23)20-5-3-9-34-16-20/h2,4,6-8,10,12-13,20H,3,5,9,11,14-16H2,1H3,(H,26,27) | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 760 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of human MGAT3 expressed in HEK293 cells assessed as effect on incorporation of [1,3-14C] glycerol into TAG by TLC method in presence of D... |
J Med Chem 58: 7164-72 (2015)
Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ |
More data for this Ligand-Target Pair | |
Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase
(Homo sapiens (Human)) | BDBM50117667
![PNG](/data/jpeg/tenK5011/BindingDB_50117667.png) (CHEMBL3613711)Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(n2)C2CCCOC2)c1 Show InChI InChI=1S/C24H27N5O5S/c1-33-21-6-2-4-17(10-21)11-24(30)28-14-18-7-8-22(12-19(18)15-28)35(31,32)27-23-13-25-29(26-23)20-5-3-9-34-16-20/h2,4,6-8,10,12-13,20H,3,5,9,11,14-16H2,1H3,(H,26,27) | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 794 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of human MGAT3 expressed in HEK293 cells assessed as effect on incorporation of [1,3-14C] glycerol into TAG by TLC method in presence of D... |
J Med Chem 58: 7164-72 (2015)
Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ |
More data for this Ligand-Target Pair | |
Ketohexokinase
(Homo sapiens (Human)) | BDBM50241197
![PNG](/data/jpeg/tenK5024/BindingDB_50241197.png) (CHEMBL4072209)Show SMILES C[C@]1(O)CCN(C1)c1nc(cc(c1C#N)C(F)(F)F)N1CCN(CCO)CC1 |r| Show InChI InChI=1S/C18H24F3N5O2/c1-17(28)2-3-26(12-17)16-13(11-22)14(18(19,20)21)10-15(23-16)25-6-4-24(5-7-25)8-9-27/h10,27-28H,2-9,12H2,1H3/t17-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Patents
| Article PubMed
| n/a | n/a | 1.03E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of recombinant human N-terminal His-tagged KHK expressed in Escherichia coli BL21(DE3) using fructose as substrate incubated for 30 mins f... |
J Med Chem 60: 7835-7849 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00947 BindingDB Entry DOI: 10.7270/Q2H997CM |
More data for this Ligand-Target Pair | |
Ketohexokinase
(Homo sapiens (Human)) | BDBM50241209
![PNG](/data/jpeg/tenK5024/BindingDB_50241209.png) (CHEMBL4101660)Show SMILES CCc1cc2nc(c(C#N)c(N3CCC(C)(O)C3)c2[nH]1)C(F)(F)F Show InChI InChI=1S/C16H17F3N4O/c1-3-9-6-11-12(21-9)13(23-5-4-15(2,24)8-23)10(7-20)14(22-11)16(17,18)19/h6,21,24H,3-5,8H2,1-2H3 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL MMDB PC cid PC sid PDB UniChem
Patents
Similars
| PDB Article PubMed
| n/a | n/a | 1.48E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of recombinant human N-terminal His-tagged KHK expressed in Escherichia coli BL21(DE3) using fructose as substrate incubated for 30 mins f... |
J Med Chem 60: 7835-7849 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00947 BindingDB Entry DOI: 10.7270/Q2H997CM |
More data for this Ligand-Target Pair | ![3D 3D](/images/Docked_3d.png) 3D Structure (crystal) |
Ketohexokinase
(Homo sapiens (Human)) | BDBM50241209
![PNG](/data/jpeg/tenK5024/BindingDB_50241209.png) (CHEMBL4101660)Show SMILES CCc1cc2nc(c(C#N)c(N3CCC(C)(O)C3)c2[nH]1)C(F)(F)F Show InChI InChI=1S/C16H17F3N4O/c1-3-9-6-11-12(21-9)13(23-5-4-15(2,24)8-23)10(7-20)14(22-11)16(17,18)19/h6,21,24H,3-5,8H2,1-2H3 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL MMDB PC cid PC sid PDB UniChem
Patents
Similars
| PDB Article PubMed
| n/a | n/a | 1.59E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of recombinant human N-terminal His-tagged KHK expressed in Escherichia coli BL21(DE3) using fructose as substrate incubated for 30 mins f... |
J Med Chem 60: 7835-7849 (2017)
Article DOI: 10.1021/acs.jmedchem.7b00947 BindingDB Entry DOI: 10.7270/Q2H997CM |
More data for this Ligand-Target Pair | ![3D 3D](/images/Docked_3d.png) 3D Structure (crystal) |
Cyclic GMP-AMP synthase
(Homo sapiens) | BDBM50250108
![PNG](/data/jpeg/tenK5025/BindingDB_50250108.png) (CHEMBL4096573)Show SMILES OC(=O)[C@@H]1CCCC[C@@H]1NC(=O)c1cnn2c(O)cc(nc12)-c1ccccc1 |r| Show InChI InChI=1S/C20H20N4O4/c25-17-10-16(12-6-2-1-3-7-12)22-18-14(11-21-24(17)18)19(26)23-15-9-5-4-8-13(15)20(27)28/h1-3,6-7,10-11,13,15,25H,4-5,8-9H2,(H,23,26)(H,27,28)/t13-,15+/m1/s1 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| Purchase
MCE PC cid PC sid PDB UniChem
Patents
Similars
| PDB Article PubMed
| n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of human cGAS (2 to 522 residues) expressed in Sf9 insect cells assessed as reduction in cGAMP level using ISD DNA as substrate in presenc... |
PLoS ONE 12: (2017)
Article DOI: 10.1371/journal.pone.0184843 BindingDB Entry DOI: 10.7270/Q2WQ067J |
More data for this Ligand-Target Pair | ![3D 3D](/images/Docked_3d.png) 3D Structure (crystal) |
Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase
(Homo sapiens (Human)) | BDBM50117660
![PNG](/data/jpeg/tenK5011/BindingDB_50117660.png) (CHEMBL3613704)Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)N(C)CCc2cccc(F)c2)c1 Show InChI InChI=1S/C26H27FN2O4S/c1-28(12-11-19-5-3-7-23(27)13-19)34(31,32)25-10-9-21-17-29(18-22(21)16-25)26(30)15-20-6-4-8-24(14-20)33-2/h3-10,13-14,16H,11-12,15,17-18H2,1-2H3 | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.51E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of MGAT3 (unknown origin) assessed effect on incorporation of [1-14C]decanoyl moiety into triacylglycerol using [1-14C]decanoyl-CoA and 1,... |
J Med Chem 58: 7164-72 (2015)
Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ |
More data for this Ligand-Target Pair | |
Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase
(Homo sapiens (Human)) | BDBM50117660
![PNG](/data/jpeg/tenK5011/BindingDB_50117660.png) (CHEMBL3613704)Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)N(C)CCc2cccc(F)c2)c1 Show InChI InChI=1S/C26H27FN2O4S/c1-28(12-11-19-5-3-7-23(27)13-19)34(31,32)25-10-9-21-17-29(18-22(21)16-25)26(30)15-20-6-4-8-24(14-20)33-2/h3-10,13-14,16H,11-12,15,17-18H2,1-2H3 | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2.74E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of MGAT3 (unknown origin) assessed effect on incorporation of [1-14C]decanoyl moiety into triacylglycerol using [1-14C]decanoyl-CoA and 1,... |
J Med Chem 58: 7164-72 (2015)
Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ |
More data for this Ligand-Target Pair | |
Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase
(Homo sapiens (Human)) | BDBM50117661
![PNG](/data/jpeg/tenK5011/BindingDB_50117661.png) (CHEMBL3613705)Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(C)n2)c1 Show InChI InChI=1S/C20H21N5O4S/c1-24-21-11-19(22-24)23-30(27,28)18-7-6-15-12-25(13-16(15)10-18)20(26)9-14-4-3-5-17(8-14)29-2/h3-8,10-11H,9,12-13H2,1-2H3,(H,22,23) | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 3.84E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of MGAT3 (unknown origin) assessed effect on incorporation of [1-14C]decanoyl moiety into triacylglycerol using [1-14C]decanoyl-CoA and 1,... |
J Med Chem 58: 7164-72 (2015)
Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ |
More data for this Ligand-Target Pair | |
Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase
(Homo sapiens (Human)) | BDBM50117661
![PNG](/data/jpeg/tenK5011/BindingDB_50117661.png) (CHEMBL3613705)Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(C)n2)c1 Show InChI InChI=1S/C20H21N5O4S/c1-24-21-11-19(22-24)23-30(27,28)18-7-6-15-12-25(13-16(15)10-18)20(26)9-14-4-3-5-17(8-14)29-2/h3-8,10-11H,9,12-13H2,1-2H3,(H,22,23) | Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 3.98E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of MGAT3 (unknown origin) assessed effect on incorporation of [1-14C]decanoyl moiety into triacylglycerol using [1-14C]decanoyl-CoA and 1,... |
J Med Chem 58: 7164-72 (2015)
Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ |
More data for this Ligand-Target Pair | |
Peroxisome proliferator-activated receptor gamma
(Homo sapiens (Human)) | BDBM50117665
![PNG](/data/jpeg/tenK5011/BindingDB_50117665.png) (CHEMBL3613709)Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(n2)C2CCC2)c1 Show InChI InChI=1S/C23H25N5O4S/c1-32-20-7-2-4-16(10-20)11-23(29)27-14-17-8-9-21(12-18(17)15-27)33(30,31)26-22-13-24-28(25-22)19-5-3-6-19/h2,4,7-10,12-13,19H,3,5-6,11,14-15H2,1H3,(H,25,26) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
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CHEMBL MCE PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of PPARgamma (unknown origin) |
J Med Chem 58: 7164-72 (2015)
Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ |
More data for this Ligand-Target Pair | |
Cyclic GMP-AMP synthase
(Homo sapiens) | BDBM50250108
![PNG](/data/jpeg/tenK5025/BindingDB_50250108.png) (CHEMBL4096573)Show SMILES OC(=O)[C@@H]1CCCC[C@@H]1NC(=O)c1cnn2c(O)cc(nc12)-c1ccccc1 |r| Show InChI InChI=1S/C20H20N4O4/c25-17-10-16(12-6-2-1-3-7-12)22-18-14(11-21-24(17)18)19(26)23-15-9-5-4-8-13(15)20(27)28/h1-3,6-7,10-11,13,15,25H,4-5,8-9H2,(H,23,26)(H,27,28)/t13-,15+/m1/s1 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
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MCE PC cid PC sid PDB UniChem
Patents
Similars
| PDB Article PubMed
| n/a | n/a | 4.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of human cGAS (2 to 522 residues) expressed in Sf9 insect cells assessed as reduction in cGAMP level using ISD DNA as substrate in presenc... |
PLoS ONE 12: (2017)
Article DOI: 10.1371/journal.pone.0184843 BindingDB Entry DOI: 10.7270/Q2WQ067J |
More data for this Ligand-Target Pair | ![3D 3D](/images/Docked_3d.png) 3D Structure (crystal) |
Cyclic GMP-AMP synthase
(Homo sapiens) | BDBM50250111
![PNG](/data/jpeg/tenK5025/BindingDB_50250111.png) (CHEMBL4084664)Show SMILES C[C@@H](CO)NC(=O)c1cnn2c(O)cc(nc12)-c1ccccc1 |r| Show InChI InChI=1S/C16H16N4O3/c1-10(9-21)18-16(23)12-8-17-20-14(22)7-13(19-15(12)20)11-5-3-2-4-6-11/h2-8,10,21-22H,9H2,1H3,(H,18,23)/t10-/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid PDB UniChem
Patents
Similars
| PDB Article PubMed
| n/a | n/a | 8.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of human cGAS (2 to 522 residues) expressed in Sf9 insect cells assessed as reduction in cGAMP level using ISD DNA as substrate in presenc... |
PLoS ONE 12: (2017)
Article DOI: 10.1371/journal.pone.0184843 BindingDB Entry DOI: 10.7270/Q2WQ067J |
More data for this Ligand-Target Pair | ![3D 3D](/images/Docked_3d.png) 3D Structure (crystal) |
Cyclic GMP-AMP synthase
(Homo sapiens) | BDBM50250109
![PNG](/data/jpeg/tenK5025/BindingDB_50250109.png) (CHEMBL4062994)Show InChI InChI=1S/C15H12N4O4/c20-12-6-11(9-4-2-1-3-5-9)18-14-10(7-17-19(12)14)15(23)16-8-13(21)22/h1-7,20H,8H2,(H,16,23)(H,21,22) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 1.06E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of human cGAS (2 to 522 residues) expressed in Sf9 insect cells assessed as reduction in cGAMP level using ISD DNA as substrate in presenc... |
PLoS ONE 12: (2017)
Article DOI: 10.1371/journal.pone.0184843 BindingDB Entry DOI: 10.7270/Q2WQ067J |
More data for this Ligand-Target Pair | |
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase
(Homo sapiens (Human)) | BDBM50117665
![PNG](/data/jpeg/tenK5011/BindingDB_50117665.png) (CHEMBL3613709)Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(n2)C2CCC2)c1 Show InChI InChI=1S/C23H25N5O4S/c1-32-20-7-2-4-16(10-20)11-23(29)27-14-17-8-9-21(12-18(17)15-27)33(30,31)26-22-13-24-28(25-22)19-5-3-6-19/h2,4,7-10,12-13,19H,3,5-6,11,14-15H2,1H3,(H,25,26) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
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CHEMBL MCE PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.48E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of MGAT1 (unknown origin) assessed as effect on incorporation of [1-14C]decanoyl moiety into DAG using [1-14C]decanoyl-CoA and 2-oleoylgly... |
J Med Chem 58: 7164-72 (2015)
Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ |
More data for this Ligand-Target Pair | |
Alpha-1,3-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase
(Homo sapiens (Human)) | BDBM50117665
![PNG](/data/jpeg/tenK5011/BindingDB_50117665.png) (CHEMBL3613709)Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(n2)C2CCC2)c1 Show InChI InChI=1S/C23H25N5O4S/c1-32-20-7-2-4-16(10-20)11-23(29)27-14-17-8-9-21(12-18(17)15-27)33(30,31)26-22-13-24-28(25-22)19-5-3-6-19/h2,4,7-10,12-13,19H,3,5-6,11,14-15H2,1H3,(H,25,26) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| Purchase
CHEMBL MCE PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.49E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of MGAT1 (unknown origin) assessed as effect on incorporation of [1-14C]decanoyl moiety into DAG using [1-14C]decanoyl-CoA and 2-oleoylgly... |
J Med Chem 58: 7164-72 (2015)
Article DOI: 10.1021/acs.jmedchem.5b01008 BindingDB Entry DOI: 10.7270/Q2F191HJ |
More data for this Ligand-Target Pair | |
Cyclic GMP-AMP synthase
(Homo sapiens) | BDBM50250106
![PNG](/data/jpeg/tenK5025/BindingDB_50250106.png) (CHEMBL4103560)Show InChI InChI=1S/C15H14N4O3/c20-7-6-16-15(22)11-9-17-19-13(21)8-12(18-14(11)19)10-4-2-1-3-5-10/h1-5,8-9,20-21H,6-7H2,(H,16,22) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet ![](/images/AffyNet_logo.png)
| KEGG PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 1.51E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description Inhibition of human cGAS (2 to 522 residues) expressed in Sf9 insect cells assessed as reduction in cGAMP level using ISD DNA as substrate in presenc... |
PLoS ONE 12: (2017)
Article DOI: 10.1371/journal.pone.0184843 BindingDB Entry DOI: 10.7270/Q2WQ067J |
More data for this Ligand-Target Pair | |