Found 117 hits with Last Name = 'forgione' and Initial = 'm' 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 |
NAD-dependent protein deacetylase sirtuin-2
(Homo sapiens (Human)) | BDBM50236570
(CHEMBL4072206)Show InChI InChI=1S/C11H10Br2N2O/c12-7-1-2-10-14-11(15-16-10)8-3-5-9(13)6-4-8/h3-6H,1-2,7H2 | PDB MMDB
NCI pathway KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 2.18E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bayreuth
Curated by ChEMBL
| Assay Description Uncompetitive inhibition of human N-terminal His6-SUMO-tagged SIRT2 catalytic domain (43 to 356 residues) deacetylase activity expressed in Escherich... |
J Med Chem 60: 2344-2360 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01609 BindingDB Entry DOI: 10.7270/Q2J968NS |
More data for this Ligand-Target Pair | |
NAD-dependent protein deacetylase sirtuin-2
(Homo sapiens (Human)) | BDBM50236570
(CHEMBL4072206)Show InChI InChI=1S/C11H10Br2N2O/c12-7-1-2-10-14-11(15-16-10)8-3-5-9(13)6-4-8/h3-6H,1-2,7H2 | PDB MMDB
NCI pathway KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 2.22E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bayreuth
Curated by ChEMBL
| Assay Description Uncompetitive inhibition of human N-terminal His6-SUMO-tagged SIRT2 catalytic domain (43 to 356 residues) deacetylase activity expressed in Escherich... |
J Med Chem 60: 2344-2360 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01609 BindingDB Entry DOI: 10.7270/Q2J968NS |
More data for this Ligand-Target Pair | |
Histone deacetylase
(Plasmodium falciparum (isolate 3D7)) | BDBM50048864
(CHEMBL3310505)Show SMILES [H][C@@]12CC(=O)N[C@H](C(C)C)C(=O)N[C@]([H])(CSSCC\C=C\1)C(=O)N\C(=C/C)C(=O)N[C@@H](C(C)C)C(=O)O2 |r,t:20| Show InChI InChI=1S/C24H36N4O6S2/c1-6-16-21(30)28-20(14(4)5)24(33)34-15-9-7-8-10-35-36-12-17(22(31)25-16)26-23(32)19(13(2)3)27-18(29)11-15/h6-7,9,13-15,17,19-20H,8,10-12H2,1-5H3,(H,25,31)(H,26,32)(H,27,29)(H,28,30)/b9-7+,16-6-/t15-,17+,19+,20-/m0/s1 | KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 0.900 | n/a | n/a | n/a | n/a | n/a | n/a |
Dipartimento di Chimica e Tecnologie del Farmaco "Sapienza" Universit£ di Roma
Curated by ChEMBL
| Assay Description Inhibition of HDAC1 in Plasmodium falciparum 3D7 nuclear extract using Ac-RGK(Ac)-AMC fluorogenic peptide as substrate preincubated for 1 hr followed... |
J Med Chem 60: 4780-4804 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01595 BindingDB Entry DOI: 10.7270/Q2JD50D0 |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038303
(CHEMBL3360522)Show SMILES [O-][N+](=O)c1ccc(SCc2ccc(cc2)C(=O)NOCc2ccccc2)c2nonc12 Show InChI InChI=1S/C21H16N4O5S/c26-21(24-29-12-14-4-2-1-3-5-14)16-8-6-15(7-9-16)13-31-18-11-10-17(25(27)28)19-20(18)23-30-22-19/h1-11H,12-13H2,(H,24,26) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Histone deacetylase
(Plasmodium falciparum (isolate 3D7)) | BDBM29589
(Faridak | LBH-589 | LBH-589B | Panobinostat | US10...)Show SMILES Cc1[nH]c2ccccc2c1CCNCc1ccc(\C=C\C(=O)NO)cc1 Show InChI InChI=1S/C21H23N3O2/c1-15-18(19-4-2-3-5-20(19)23-15)12-13-22-14-17-8-6-16(7-9-17)10-11-21(25)24-26/h2-11,22-23,26H,12-14H2,1H3,(H,24,25)/b11-10+ | KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| Purchase
MCE PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 3.30 | n/a | n/a | n/a | n/a | n/a | n/a |
Dipartimento di Chimica e Tecnologie del Farmaco "Sapienza" Universit£ di Roma
Curated by ChEMBL
| Assay Description Inhibition of HDAC1 in Plasmodium falciparum 3D7 nuclear extract using Ac-RGK(Ac)-AMC fluorogenic peptide as substrate preincubated for 1 hr followed... |
J Med Chem 60: 4780-4804 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01595 BindingDB Entry DOI: 10.7270/Q2JD50D0 |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038330
(CHEMBL3360531)Show InChI InChI=1S/C13H15N3O3S/c17-16(18)10-6-7-11(13-12(10)14-19-15-13)20-8-9-4-2-1-3-5-9/h6-7,9H,1-5,8H2 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038328
(CHEMBL3360529)Show SMILES COC(=O)C(CSc1ccc([N+]([O-])=O)c2nonc12)NC(=O)OC(C)(C)C Show InChI InChI=1S/C15H18N4O7S/c1-15(2,3)25-14(21)16-8(13(20)24-4)7-27-10-6-5-9(19(22)23)11-12(10)18-26-17-11/h5-6,8H,7H2,1-4H3,(H,16,21) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038305
(CHEMBL3352898)Show SMILES OC(=O)c1ccc(CSc2ccc([N+]([O-])=O)c3nonc23)cc1 Show InChI InChI=1S/C14H9N3O5S/c18-14(19)9-3-1-8(2-4-9)7-23-11-6-5-10(17(20)21)12-13(11)16-22-15-12/h1-6H,7H2,(H,18,19) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| 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 |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038334
(CHEMBL3360535)Show InChI InChI=1S/C14H19N3O4S/c18-9-5-3-1-2-4-6-10-22-12-8-7-11(17(19)20)13-14(12)16-21-15-13/h7-8,18H,1-6,9-10H2 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| 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 |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038304
(CHEMBL3360521)Show SMILES CCOC(=O)c1ccc(CSc2ccc([N+]([O-])=O)c3nonc23)cc1 Show InChI InChI=1S/C16H13N3O5S/c1-2-23-16(20)11-5-3-10(4-6-11)9-25-13-8-7-12(19(21)22)14-15(13)18-24-17-14/h3-8H,2,9H2,1H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038329
(CHEMBL3360530)Show SMILES COC(=O)C(CSc1ccc([N+]([O-])=O)c2nonc12)NC(=O)OCc1ccccc1 Show InChI InChI=1S/C18H16N4O7S/c1-27-17(23)12(19-18(24)28-9-11-5-3-2-4-6-11)10-30-14-8-7-13(22(25)26)15-16(14)21-29-20-15/h2-8,12H,9-10H2,1H3,(H,19,24) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 8 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038321
(CHEMBL3360505)Show InChI InChI=1S/C15H13N3O3S/c19-18(20)12-8-9-13(15-14(12)16-21-17-15)22-10-4-7-11-5-2-1-3-6-11/h1-3,5-6,8-9H,4,7,10H2 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038325
(CHEMBL1234570)Show InChI InChI=1S/C12H15N3O4S/c16-7-3-1-2-4-8-20-10-6-5-9(15(17)18)11-12(10)14-19-13-11/h5-6,16H,1-4,7-8H2 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid PDB UniChem
Similars
| Article PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038308
(CHEMBL3360518)Show SMILES OC(=O)Cc1ccc(Sc2ccc([N+]([O-])=O)c3nonc23)cc1 Show InChI InChI=1S/C14H9N3O5S/c18-12(19)7-8-1-3-9(4-2-8)23-11-6-5-10(17(20)21)13-14(11)16-22-15-13/h1-6H,7H2,(H,18,19) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038306
(CHEMBL3360520)Show SMILES [O-][N+](=O)c1ccc(Sc2ccc(CCC(=O)NOCc3ccccc3)cc2)c2nonc12 Show InChI InChI=1S/C22H18N4O5S/c27-20(23-30-14-16-4-2-1-3-5-16)13-8-15-6-9-17(10-7-15)32-19-12-11-18(26(28)29)21-22(19)25-31-24-21/h1-7,9-12H,8,13-14H2,(H,23,27) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038322
(CHEMBL3360504)Show InChI InChI=1S/C14H11N3O3S/c18-17(19)11-6-7-12(14-13(11)15-20-16-14)21-9-8-10-4-2-1-3-5-10/h1-7H,8-9H2 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038323
(CHEMBL2430532)Show InChI InChI=1S/C13H9N3O3S/c17-16(18)10-6-7-11(13-12(10)14-19-15-13)20-8-9-4-2-1-3-5-9/h1-7H,8H2 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038311
(CHEMBL3360515)Show SMILES [O-][N+](=O)c1ccc(Sc2ccc(cc2)C(=O)NOCc2ccccc2)c2nonc12 Show InChI InChI=1S/C20H14N4O5S/c25-20(23-28-12-13-4-2-1-3-5-13)14-6-8-15(9-7-14)30-17-11-10-16(24(26)27)18-19(17)22-29-21-18/h1-11H,12H2,(H,23,25) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038307
(CHEMBL3360519)Show SMILES OC(=O)CCc1ccc(Sc2ccc([N+]([O-])=O)c3nonc23)cc1 Show InChI InChI=1S/C15H11N3O5S/c19-13(20)8-3-9-1-4-10(5-2-9)24-12-7-6-11(18(21)22)14-15(12)17-23-16-14/h1-2,4-7H,3,8H2,(H,19,20) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Histone deacetylase
(Plasmodium falciparum (isolate 3D7)) | BDBM27179
(triazole-linked azithromycin-based compound, 16c)Show SMILES CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@@H]([C@H]2O)N(C)Cc2ccc(cc2)-c2cn(CCCCCCC(=O)NO)nn2)[C@](C)(O)C[C@@H](C)CN(C)[C@H](C)[C@@H](O)[C@]1(C)O Show InChI InChI=1S/C53H90N6O14/c1-14-41-53(10,66)46(62)35(6)57(11)28-31(2)26-51(8,65)48(33(4)45(34(5)49(64)71-41)72-43-27-52(9,68-13)47(63)36(7)70-43)73-50-44(61)40(25-32(3)69-50)58(12)29-37-20-22-38(23-21-37)39-30-59(56-54-39)24-18-16-15-17-19-42(60)55-67/h20-23,30-36,40-41,43-48,50,61-63,65-67H,14-19,24-29H2,1-13H3,(H,55,60)/t31-,32-,33+,34-,35-,36+,40+,41-,43+,44-,45+,46-,47+,48-,50+,51-,52-,53-/m1/s1 | KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 29 | n/a | n/a | n/a | n/a | n/a | n/a |
Dipartimento di Chimica e Tecnologie del Farmaco "Sapienza" Universit£ di Roma
Curated by ChEMBL
| Assay Description Inhibition of recombinant Plasmodium falciparum HDAC1 using HDAC substrate-3 after 30 mins by fluorescence assay |
J Med Chem 60: 4780-4804 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01595 BindingDB Entry DOI: 10.7270/Q2JD50D0 |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038302
(CHEMBL3360523)Show SMILES CONC(=O)c1ccc(CCSc2ccc([N+]([O-])=O)c3nonc23)cc1 Show InChI InChI=1S/C16H14N4O5S/c1-24-19-16(21)11-4-2-10(3-5-11)8-9-26-13-7-6-12(20(22)23)14-15(13)18-25-17-14/h2-7H,8-9H2,1H3,(H,19,21) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038301
(CHEMBL3360524)Show InChI InChI=1S/C10H9N3O5S/c1-17-8(14)4-5-19-7-3-2-6(13(15)16)9-10(7)12-18-11-9/h2-3H,4-5H2,1H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038327
(CHEMBL3360528)Show SMILES [O-][N+](=O)c1ccc(SCCC(=O)N2CCC(=O)CC2)c2nonc12 Show InChI InChI=1S/C14H14N4O5S/c19-9-3-6-17(7-4-9)12(20)5-8-24-11-2-1-10(18(21)22)13-14(11)16-23-15-13/h1-2H,3-8H2 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038333
(CHEMBL3360534)Show InChI InChI=1S/C10H11N3O4S/c14-5-1-2-6-18-8-4-3-7(13(15)16)9-10(8)12-17-11-9/h3-4,14H,1-2,5-6H2 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038326
(CHEMBL3360527)Show InChI InChI=1S/C13H14N4O4S/c18-9-3-5-16(6-4-9)7-8-22-11-2-1-10(17(19)20)12-13(11)15-21-14-12/h1-2H,3-8H2 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038331
(CHEMBL3360532)Show InChI InChI=1S/C10H11N3O3S/c1-10(2,3)17-7-5-4-6(13(14)15)8-9(7)12-16-11-8/h4-5H,1-3H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038324
(CHEMBL2430537)Show InChI InChI=1S/C12H7N3O3S/c16-15(17)9-6-7-10(12-11(9)13-18-14-12)19-8-4-2-1-3-5-8/h1-7H | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038315
(CHEMBL3360511)Show SMILES ONC(=O)c1ccc(Sc2ccc([N+]([O-])=O)c3nonc23)cc1 Show InChI InChI=1S/C13H8N4O5S/c18-13(14-19)7-1-3-8(4-2-7)23-10-6-5-9(17(20)21)11-12(10)16-22-15-11/h1-6,19H,(H,14,18) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 50 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038299
(CHEMBL3360526)Show InChI InChI=1S/C11H12N4O5S/c16-5-4-12-9(17)3-6-21-8-2-1-7(15(18)19)10-11(8)14-20-13-10/h1-2,16H,3-6H2,(H,12,17) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 60 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038300
(CHEMBL3360525)Show InChI InChI=1S/C10H10N4O4S/c1-6(15)11-4-5-19-8-3-2-7(14(16)17)9-10(8)13-18-12-9/h2-3H,4-5H2,1H3,(H,11,15) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 70 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038332
(CHEMBL3360533)Show InChI InChI=1S/C9H9N3O5S/c13-3-5(14)4-18-7-2-1-6(12(15)16)8-9(7)11-17-10-8/h1-2,5,13-14H,3-4H2 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 70 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038319
(CHEMBL3360507)Show SMILES OC(=O)c1cccc(Sc2ccc([N+]([O-])=O)c3nonc23)c1 Show InChI InChI=1S/C13H7N3O5S/c17-13(18)7-2-1-3-8(6-7)22-10-5-4-9(16(19)20)11-12(10)15-21-14-11/h1-6H,(H,17,18) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 80 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase P
(Homo sapiens (Human)) | BDBM50038302
(CHEMBL3360523)Show SMILES CONC(=O)c1ccc(CCSc2ccc([N+]([O-])=O)c3nonc23)cc1 Show InChI InChI=1S/C16H14N4O5S/c1-24-19-16(21)11-4-2-10(3-5-11)8-9-26-13-7-6-12(20(22)23)14-15(13)18-25-17-14/h2-7H,8-9H2,1H3,(H,19,21) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 100 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTP1-1 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase P
(Homo sapiens (Human)) | BDBM50038306
(CHEMBL3360520)Show SMILES [O-][N+](=O)c1ccc(Sc2ccc(CCC(=O)NOCc3ccccc3)cc2)c2nonc12 Show InChI InChI=1S/C22H18N4O5S/c27-20(23-30-14-16-4-2-1-3-5-16)13-8-15-6-9-17(10-7-15)32-19-12-11-18(26(28)29)21-22(19)25-31-24-21/h1-7,9-12H,8,13-14H2,(H,23,27) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 100 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTP1-1 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038313
(CHEMBL3360513)Show SMILES CONC(=O)c1ccc(Sc2ccc([N+]([O-])=O)c3nonc23)cc1 Show InChI InChI=1S/C14H10N4O5S/c1-22-17-14(19)8-2-4-9(5-3-8)24-11-7-6-10(18(20)21)12-13(11)16-23-15-12/h2-7H,1H3,(H,17,19) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 130 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038317
(CHEMBL3360509)Show SMILES CCOC(=O)c1ccc(Sc2ccc([N+]([O-])=O)c3nonc23)cc1 Show InChI InChI=1S/C15H11N3O5S/c1-2-22-15(19)9-3-5-10(6-4-9)24-12-8-7-11(18(20)21)13-14(12)17-23-16-13/h3-8H,2H2,1H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 140 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038314
(CHEMBL3360512)Show SMILES CN(C)C(=O)c1ccc(Sc2ccc([N+]([O-])=O)c3nonc23)cc1 Show InChI InChI=1S/C15H12N4O4S/c1-18(2)15(20)9-3-5-10(6-4-9)24-12-8-7-11(19(21)22)13-14(12)17-23-16-13/h3-8H,1-2H3 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 190 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase P
(Homo sapiens (Human)) | BDBM50038303
(CHEMBL3360522)Show SMILES [O-][N+](=O)c1ccc(SCc2ccc(cc2)C(=O)NOCc2ccccc2)c2nonc12 Show InChI InChI=1S/C21H16N4O5S/c26-21(24-29-12-14-4-2-1-3-5-14)16-8-6-15(7-9-16)13-31-18-11-10-17(25(27)28)19-20(18)23-30-22-19/h1-11H,12-13H2,(H,24,26) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTP1-1 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038316
(CHEMBL3360510)Show SMILES NC(=O)c1ccc(Sc2ccc([N+]([O-])=O)c3nonc23)cc1 Show InChI InChI=1S/C13H8N4O4S/c14-13(18)7-1-3-8(4-2-7)22-10-6-5-9(17(19)20)11-12(10)16-21-15-11/h1-6H,(H2,14,18) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase P
(Homo sapiens (Human)) | BDBM50038322
(CHEMBL3360504)Show InChI InChI=1S/C14H11N3O3S/c18-17(19)11-6-7-12(14-13(11)15-20-16-14)21-9-8-10-4-2-1-3-5-10/h1-7H,8-9H2 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTP1-1 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Histone deacetylase
(Plasmodium falciparum (isolate 3D7)) | BDBM25150
((2E)-N-hydroxy-3-[3-(phenylsulfamoyl)phenyl]prop-2...)Show InChI InChI=1S/C15H14N2O4S/c18-15(16-19)10-9-12-5-4-8-14(11-12)22(20,21)17-13-6-2-1-3-7-13/h1-11,17,19H,(H,16,18)/b10-9+ | KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| Purchase
MCE PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 215 | n/a | n/a | n/a | n/a | n/a | n/a |
Dipartimento di Chimica e Tecnologie del Farmaco "Sapienza" Universit£ di Roma
Curated by ChEMBL
| Assay Description Inhibition of HDAC1 in Plasmodium falciparum 3D7 nuclear extract using Ac-RGK(Ac)-AMC fluorogenic peptide as substrate preincubated for 1 hr followed... |
J Med Chem 60: 4780-4804 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01595 BindingDB Entry DOI: 10.7270/Q2JD50D0 |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038318
(CHEMBL3360508)Show SMILES OC(=O)c1ccc(Sc2ccc([N+]([O-])=O)c3nonc23)cc1 Show InChI InChI=1S/C13H7N3O5S/c17-13(18)7-1-3-8(4-2-7)22-10-6-5-9(16(19)20)11-12(10)15-21-14-11/h1-6H,(H,17,18) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 230 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038312
(CHEMBL3360514)Show SMILES [O-][N+](=O)c1ccc(Sc2ccc(cc2)C(=O)NOC2CCCCO2)c2nonc12 Show InChI InChI=1S/C18H16N4O6S/c23-18(21-27-15-3-1-2-10-26-15)11-4-6-12(7-5-11)29-14-9-8-13(22(24)25)16-17(14)20-28-19-16/h4-9,15H,1-3,10H2,(H,21,23) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 300 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase P
(Homo sapiens (Human)) | BDBM50038331
(CHEMBL3360532)Show InChI InChI=1S/C10H11N3O3S/c1-10(2,3)17-7-5-4-6(13(14)15)8-9(7)12-16-11-8/h4-5H,1-3H3 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 300 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTP1-1 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase P
(Homo sapiens (Human)) | BDBM50038330
(CHEMBL3360531)Show InChI InChI=1S/C13H15N3O3S/c17-16(18)10-6-7-11(13-12(10)14-19-15-13)20-8-9-4-2-1-3-5-9/h6-7,9H,1-5,8H2 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 300 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTP1-1 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase P
(Homo sapiens (Human)) | BDBM50038329
(CHEMBL3360530)Show SMILES COC(=O)C(CSc1ccc([N+]([O-])=O)c2nonc12)NC(=O)OCc1ccccc1 Show InChI InChI=1S/C18H16N4O7S/c1-27-17(23)12(19-18(24)28-9-11-5-3-2-4-6-11)10-30-14-8-7-13(22(25)26)15-16(14)21-29-20-15/h2-8,12H,9-10H2,1H3,(H,19,24) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 400 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTP1-1 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase P
(Homo sapiens (Human)) | BDBM50038308
(CHEMBL3360518)Show SMILES OC(=O)Cc1ccc(Sc2ccc([N+]([O-])=O)c3nonc23)cc1 Show InChI InChI=1S/C14H9N3O5S/c18-12(19)7-8-1-3-9(4-2-8)23-11-6-5-10(17(20)21)13-14(11)16-22-15-13/h1-6H,7H2,(H,18,19) | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 400 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTP1-1 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Histone deacetylase
(Plasmodium falciparum (isolate 3D7)) | BDBM50453752
(CHEMBL4213473)Show SMILES [H][C@@]1(C[C@@](C)(OC)[C@@H](O)[C@H](C)O1)O[C@H]1[C@H](C)[C@@H](O[C@]2([H])O[C@H](C)C[C@@H]([C@H]2O)N(C)Cc2ccc(cc2)-c2cn(CCCCCCCCCC(=O)NO)nn2)[C@](C)(O)C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@](C)(O)[C@@H](CC)OC(=O)[C@@H]1C |r| Show InChI InChI=1S/C55H91N5O15/c1-13-42-55(10,68)48(64)34(4)45(62)32(2)28-53(8,67)50(35(5)47(36(6)51(66)73-42)74-44-29-54(9,70-12)49(65)37(7)72-44)75-52-46(63)41(27-33(3)71-52)59(11)30-38-22-24-39(25-23-38)40-31-60(58-56-40)26-20-18-16-14-15-17-19-21-43(61)57-69/h22-25,31-37,41-42,44,46-50,52,63-65,67-69H,13-21,26-30H2,1-12H3,(H,57,61)/t32-,33-,34+,35+,36-,37+,41+,42-,44+,46-,47+,48-,49+,50-,52+,53-,54-,55-/m1/s1 | KEGG
UniProtKB/TrEMBL
GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 401 | n/a | n/a | n/a | n/a | n/a | n/a |
Dipartimento di Chimica e Tecnologie del Farmaco "Sapienza" Universit£ di Roma
Curated by ChEMBL
| Assay Description Inhibition of recombinant Plasmodium falciparum HDAC1 using HDAC substrate-3 after 30 mins by fluorescence assay |
J Med Chem 60: 4780-4804 (2017)
Article DOI: 10.1021/acs.jmedchem.6b01595 BindingDB Entry DOI: 10.7270/Q2JD50D0 |
More data for this Ligand-Target Pair | |
Glutathione S-transferase Mu 2
(Homo sapiens (Human)) | BDBM50038310
(CHEMBL3360516)Show SMILES OCCNC(=O)c1ccc(Sc2ccc([N+]([O-])=O)c3nonc23)cc1 Show InChI InChI=1S/C15H12N4O5S/c20-8-7-16-15(21)9-1-3-10(4-2-9)25-12-6-5-11(19(22)23)13-14(12)18-24-17-13/h1-6,20H,7-8H2,(H,16,21) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 410 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTM2-2 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |
Glutathione S-transferase P
(Homo sapiens (Human)) | BDBM50038334
(CHEMBL3360535)Show InChI InChI=1S/C14H19N3O4S/c18-9-5-3-1-2-4-6-10-22-12-8-7-11(17(19)20)13-14(12)16-21-15-13/h7-8,18H,1-6,9-10H2 | PDB
UniProtKB/SwissProt
antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 500 | n/a | n/a | n/a | n/a | n/a | n/a |
"Sapienza" University of Rome
Curated by ChEMBL
| Assay Description Inhibition of GSTP1-1 (unknown origin) using GSH substrate by spectrophotometric method |
Eur J Med Chem 89: 156-71 (2014)
Article DOI: 10.1016/j.ejmech.2014.10.033 BindingDB Entry DOI: 10.7270/Q26D5VMX |
More data for this Ligand-Target Pair | |