Found 7 hits for monomerid = 489104 Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
L-lactate dehydrogenase A chain
(Homo sapiens (Human)) | BDBM489104
(2-(5- (cyclopropylmethyl)- 3-(3- (phenylamino)phen...)Show SMILES NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(Nc3ccccc3)c2)-c2nc(cs2)C(O)=O)cc1 Show InChI InChI=1S/C30H27N5O4S2/c31-41(38,39)24-13-11-19(12-14-24)15-25-27(16-20-9-10-20)35(30-33-26(18-40-30)29(36)37)34-28(25)21-5-4-8-23(17-21)32-22-6-2-1-3-7-22/h1-8,11-14,17-18,20,32H,9-10,15-16H2,(H,36,37)(H2,31,38,39) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| US Patent
| n/a | n/a | <100 | n/a | n/a | n/a | n/a | n/a | n/a |
THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES; VANDERBILT UNIVERSITY; THE UAB RESEARCH FOUNDATION; THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA
US Patent
| Assay Description Test compounds were placed in a Greiner Bio-One (Monroe, N.C.) 1536-well black solid bottom assay plate. 200 millimolar (mM) Tris HCl, pH 7.4, 100 mi... |
US Patent US10961200 (2021)
BindingDB Entry DOI: 10.7270/Q2474DZ9 |
More data for this Ligand-Target Pair | |
L-lactate dehydrogenase A chain
(Homo sapiens (Human)) | BDBM489104
(2-(5- (cyclopropylmethyl)- 3-(3- (phenylamino)phen...)Show SMILES NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(Nc3ccccc3)c2)-c2nc(cs2)C(O)=O)cc1 Show InChI InChI=1S/C30H27N5O4S2/c31-41(38,39)24-13-11-19(12-14-24)15-25-27(16-20-9-10-20)35(30-33-26(18-40-30)29(36)37)34-28(25)21-5-4-8-23(17-21)32-22-6-2-1-3-7-22/h1-8,11-14,17-18,20,32H,9-10,15-16H2,(H,36,37)(H2,31,38,39) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| | n/a | n/a | <100 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2PN98TV |
More data for this Ligand-Target Pair | |
L-lactate dehydrogenase A chain
(Homo sapiens (Human)) | BDBM489104
(2-(5- (cyclopropylmethyl)- 3-(3- (phenylamino)phen...)Show SMILES NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(Nc3ccccc3)c2)-c2nc(cs2)C(O)=O)cc1 Show InChI InChI=1S/C30H27N5O4S2/c31-41(38,39)24-13-11-19(12-14-24)15-25-27(16-20-9-10-20)35(30-33-26(18-40-30)29(36)37)34-28(25)21-5-4-8-23(17-21)32-22-6-2-1-3-7-22/h1-8,11-14,17-18,20,32H,9-10,15-16H2,(H,36,37)(H2,31,38,39) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 314 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1016/j.bmcl.2021.127974 BindingDB Entry DOI: 10.7270/Q24J0JV6 |
More data for this Ligand-Target Pair | |
L-lactate dehydrogenase A chain
(Homo sapiens (Human)) | BDBM489104
(2-(5- (cyclopropylmethyl)- 3-(3- (phenylamino)phen...)Show SMILES NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(Nc3ccccc3)c2)-c2nc(cs2)C(O)=O)cc1 Show InChI InChI=1S/C30H27N5O4S2/c31-41(38,39)24-13-11-19(12-14-24)15-25-27(16-20-9-10-20)35(30-33-26(18-40-30)29(36)37)34-28(25)21-5-4-8-23(17-21)32-22-6-2-1-3-7-22/h1-8,11-14,17-18,20,32H,9-10,15-16H2,(H,36,37)(H2,31,38,39) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | 1.5 | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1016/j.bmcl.2021.127974 BindingDB Entry DOI: 10.7270/Q24J0JV6 |
More data for this Ligand-Target Pair | |
L-lactate dehydrogenase B chain
(Homo sapiens (Human)) | BDBM489104
(2-(5- (cyclopropylmethyl)- 3-(3- (phenylamino)phen...)Show SMILES NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(Nc3ccccc3)c2)-c2nc(cs2)C(O)=O)cc1 Show InChI InChI=1S/C30H27N5O4S2/c31-41(38,39)24-13-11-19(12-14-24)15-25-27(16-20-9-10-20)35(30-33-26(18-40-30)29(36)37)34-28(25)21-5-4-8-23(17-21)32-22-6-2-1-3-7-22/h1-8,11-14,17-18,20,32H,9-10,15-16H2,(H,36,37)(H2,31,38,39) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1016/j.bmcl.2021.127974 BindingDB Entry DOI: 10.7270/Q24J0JV6 |
More data for this Ligand-Target Pair | |
L-lactate dehydrogenase A chain
(Homo sapiens (Human)) | BDBM489104
(2-(5- (cyclopropylmethyl)- 3-(3- (phenylamino)phen...)Show SMILES NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(Nc3ccccc3)c2)-c2nc(cs2)C(O)=O)cc1 Show InChI InChI=1S/C30H27N5O4S2/c31-41(38,39)24-13-11-19(12-14-24)15-25-27(16-20-9-10-20)35(30-33-26(18-40-30)29(36)37)34-28(25)21-5-4-8-23(17-21)32-22-6-2-1-3-7-22/h1-8,11-14,17-18,20,32H,9-10,15-16H2,(H,36,37)(H2,31,38,39) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 3.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1016/j.bmcl.2021.127974 BindingDB Entry DOI: 10.7270/Q24J0JV6 |
More data for this Ligand-Target Pair | |
L-lactate dehydrogenase A chain
(Homo sapiens (Human)) | BDBM489104
(2-(5- (cyclopropylmethyl)- 3-(3- (phenylamino)phen...)Show SMILES NS(=O)(=O)c1ccc(Cc2c(CC3CC3)n(nc2-c2cccc(Nc3ccccc3)c2)-c2nc(cs2)C(O)=O)cc1 Show InChI InChI=1S/C30H27N5O4S2/c31-41(38,39)24-13-11-19(12-14-24)15-25-27(16-20-9-10-20)35(30-33-26(18-40-30)29(36)37)34-28(25)21-5-4-8-23(17-21)32-22-6-2-1-3-7-22/h1-8,11-14,17-18,20,32H,9-10,15-16H2,(H,36,37)(H2,31,38,39) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 6.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1016/j.bmcl.2021.127974 BindingDB Entry DOI: 10.7270/Q24J0JV6 |
More data for this Ligand-Target Pair | |