Found 12 hits with Last Name = 'auschwitz' and Initial = 'jm' 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 |
Enoyl-acyl carrier reductase ENR
(Toxoplasma gondii) | BDBM8726
(5-chloro-2-(2,4-dichlorophenoxy)phenol | CHEMBL849...)Show InChI InChI=1S/C12H7Cl3O2/c13-7-1-3-11(9(15)5-7)17-12-4-2-8(14)6-10(12)16/h1-6,16H | PDB MMDB
KEGG
UniProtKB/TrEMBL
B.MOAD GoogleScholar AffyNet
| Purchase
CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| PDB Article PubMed
| n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii enoyl reductase assessed as conversion of trans-2-acyl-ACP to acyl-ACP |
Bioorg Med Chem Lett 23: 2035-43 (2013)
Article DOI: 10.1016/j.bmcl.2013.02.019 BindingDB Entry DOI: 10.7270/Q29Z968J |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Enoyl-acyl carrier reductase ENR
(Toxoplasma gondii) | BDBM8726
(5-chloro-2-(2,4-dichlorophenoxy)phenol | CHEMBL849...)Show InChI InChI=1S/C12H7Cl3O2/c13-7-1-3-11(9(15)5-7)17-12-4-2-8(14)6-10(12)16/h1-6,16H | PDB MMDB
KEGG
UniProtKB/TrEMBL
B.MOAD GoogleScholar AffyNet
| Purchase
CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| PDB Article PubMed
| n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Leeds
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii enoyl acyl-carrier protein reductase |
Bioorg Med Chem Lett 23: 3551-5 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.035 BindingDB Entry DOI: 10.7270/Q2XK8GZ7 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Enoyl-acyl carrier reductase ENR
(Toxoplasma gondii) | BDBM50435717
(CHEMBL2392450 | N‐{[4‐(2,4‐dichl...)Show SMILES Cc1cc(no1)C(=O)NCc1ccc(Oc2ccc(Cl)cc2Cl)c(O)c1 Show InChI InChI=1S/C18H14Cl2N2O4/c1-10-6-14(22-26-10)18(24)21-9-11-2-4-17(15(23)7-11)25-16-5-3-12(19)8-13(16)20/h2-8,23H,9H2,1H3,(H,21,24) | PDB MMDB
KEGG
UniProtKB/TrEMBL
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 19 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Leeds
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii enoyl acyl-carrier protein reductase |
Bioorg Med Chem Lett 23: 3551-5 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.035 BindingDB Entry DOI: 10.7270/Q2XK8GZ7 |
More data for this Ligand-Target Pair | |
Enoyl-acyl carrier reductase ENR
(Toxoplasma gondii) | BDBM50435720
(CHEMBL2392447)Show InChI InChI=1S/C19H15ClN2O3/c1-2-3-14-10-16(22-25-14)13-5-7-18(15(20)9-13)24-19-6-4-12(11-21)8-17(19)23/h4-10,23H,2-3H2,1H3 | PDB MMDB
KEGG
UniProtKB/TrEMBL
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 29 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Leeds
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii enoyl acyl-carrier protein reductase |
Bioorg Med Chem Lett 23: 3551-5 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.035 BindingDB Entry DOI: 10.7270/Q2XK8GZ7 |
More data for this Ligand-Target Pair | |
Enoyl-acyl carrier reductase ENR
(Toxoplasma gondii) | BDBM50431922
(5‐chloro‐2‐[2‐chloro‐...)Show InChI InChI=1S/C13H7Cl2F3O2/c14-8-2-4-12(10(19)6-8)20-11-3-1-7(5-9(11)15)13(16,17)18/h1-6,19H | PDB MMDB
KEGG
UniProtKB/TrEMBL
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii enoyl reductase assessed as conversion of trans-2-acyl-ACP to acyl-ACP |
Bioorg Med Chem Lett 23: 2035-43 (2013)
Article DOI: 10.1016/j.bmcl.2013.02.019 BindingDB Entry DOI: 10.7270/Q29Z968J |
More data for this Ligand-Target Pair | |
Enoyl-acyl carrier reductase ENR
(Toxoplasma gondii) | BDBM50435719
(CHEMBL2392448)Show InChI InChI=1S/C18H13ClN2O4/c19-14-8-12(15-9-13(5-6-22)25-21-15)2-4-17(14)24-18-3-1-11(10-20)7-16(18)23/h1-4,7-9,22-23H,5-6H2 | PDB MMDB
KEGG
UniProtKB/TrEMBL
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 34 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Leeds
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii enoyl acyl-carrier protein reductase |
Bioorg Med Chem Lett 23: 3551-5 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.035 BindingDB Entry DOI: 10.7270/Q2XK8GZ7 |
More data for this Ligand-Target Pair | |
Enoyl-acyl carrier reductase ENR
(Toxoplasma gondii) | BDBM50431923
(5‐chloro‐2‐(naphthalen‐2...)Show InChI InChI=1S/C16H11ClO2/c17-13-6-8-16(15(18)10-13)19-14-7-5-11-3-1-2-4-12(11)9-14/h1-10,18H | PDB MMDB
KEGG
UniProtKB/TrEMBL
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 41 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii enoyl reductase assessed as conversion of trans-2-acyl-ACP to acyl-ACP |
Bioorg Med Chem Lett 23: 2035-43 (2013)
Article DOI: 10.1016/j.bmcl.2013.02.019 BindingDB Entry DOI: 10.7270/Q29Z968J |
More data for this Ligand-Target Pair | |
Enoyl-acyl carrier reductase ENR
(Toxoplasma gondii) | BDBM50431920
(5‐(4‐chloro‐2‐hydroxypheno...)Show InChI InChI=1S/C15H11ClN2O5/c1-8-6-13(18-23-8)17-15(20)12-4-5-14(22-12)21-11-3-2-9(16)7-10(11)19/h2-7,19H,1H3,(H,17,18,20) | PDB MMDB
KEGG
UniProtKB/TrEMBL
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 58 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii enoyl reductase assessed as conversion of trans-2-acyl-ACP to acyl-ACP |
Bioorg Med Chem Lett 23: 2035-43 (2013)
Article DOI: 10.1016/j.bmcl.2013.02.019 BindingDB Entry DOI: 10.7270/Q29Z968J |
More data for this Ligand-Target Pair | |
Enoyl-acyl carrier reductase ENR
(Toxoplasma gondii) | BDBM50431918
(CHEMBL2347828)Show InChI InChI=1S/C15H10ClNO2/c16-11-3-6-15(14(18)9-11)19-12-4-5-13-10(8-12)2-1-7-17-13/h1-9,18H | PDB MMDB
KEGG
UniProtKB/TrEMBL
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 135 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii enoyl reductase assessed as conversion of trans-2-acyl-ACP to acyl-ACP |
Bioorg Med Chem Lett 23: 2035-43 (2013)
Article DOI: 10.1016/j.bmcl.2013.02.019 BindingDB Entry DOI: 10.7270/Q29Z968J |
More data for this Ligand-Target Pair | |
Enoyl-acyl carrier reductase ENR
(Toxoplasma gondii) | BDBM50435718
(CHEMBL2392449)Show SMILES CCCc1cc(no1)-c1ccc(Oc2ccc(CNC(=O)c3cc(C)on3)cc2O)c(Cl)c1 Show InChI InChI=1S/C24H22ClN3O5/c1-3-4-17-12-19(27-33-17)16-6-8-22(18(25)11-16)31-23-7-5-15(10-21(23)29)13-26-24(30)20-9-14(2)32-28-20/h5-12,29H,3-4,13H2,1-2H3,(H,26,30) | PDB MMDB
KEGG
UniProtKB/TrEMBL
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 137 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Leeds
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii enoyl acyl-carrier protein reductase |
Bioorg Med Chem Lett 23: 3551-5 (2013)
Article DOI: 10.1016/j.bmcl.2013.04.035 BindingDB Entry DOI: 10.7270/Q2XK8GZ7 |
More data for this Ligand-Target Pair | |
Enoyl-acyl carrier reductase ENR
(Toxoplasma gondii) | BDBM50431921
(CHEMBL2347842)Show InChI InChI=1S/C18H19ClN2O3/c1-13(22)20-8-10-21(11-9-20)15-3-5-16(6-4-15)24-18-7-2-14(19)12-17(18)23/h2-7,12,23H,8-11H2,1H3 | PDB MMDB
KEGG
UniProtKB/TrEMBL
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 225 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii enoyl reductase assessed as conversion of trans-2-acyl-ACP to acyl-ACP |
Bioorg Med Chem Lett 23: 2035-43 (2013)
Article DOI: 10.1016/j.bmcl.2013.02.019 BindingDB Entry DOI: 10.7270/Q29Z968J |
More data for this Ligand-Target Pair | |
Enoyl-acyl carrier reductase ENR
(Toxoplasma gondii) | BDBM50431919
(CHEMBL2347830)Show InChI InChI=1S/C17H19ClN2O3S/c1-12(21)20-8-6-19(7-9-20)11-14-3-5-17(24-14)23-16-4-2-13(18)10-15(16)22/h2-5,10,22H,6-9,11H2,1H3 | PDB MMDB
KEGG
UniProtKB/TrEMBL
B.MOAD GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 965 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois at Chicago
Curated by ChEMBL
| Assay Description Inhibition of Toxoplasma gondii enoyl reductase assessed as conversion of trans-2-acyl-ACP to acyl-ACP |
Bioorg Med Chem Lett 23: 2035-43 (2013)
Article DOI: 10.1016/j.bmcl.2013.02.019 BindingDB Entry DOI: 10.7270/Q29Z968J |
More data for this Ligand-Target Pair | |