Found 4 hits Enz. Inhib. hit(s) with Target = 'NAD synthetase' 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 |
|---|
Glutamine-dependent NAD(+) synthetase
(Homo sapiens (Human)) | BDBM92597
(CHEMBL324501 | NAD Synthetase Inhibitor, 2)Show SMILES C[N+](C)(C)c1ccc(CC(=O)OCCCCCCCCn2ccc3cc(OCc4ccccc4)ccc23)cc1 Show InChI InChI=1S/C34H43N2O3/c1-36(2,3)31-17-15-28(16-18-31)25-34(37)38-24-12-7-5-4-6-11-22-35-23-21-30-26-32(19-20-33(30)35)39-27-29-13-9-8-10-14-29/h8-10,13-21,23,26H,4-7,11-12,22,24-25,27H2,1-3H3/q+1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.48E+4 | n/a | n/a | n/a | n/a | 8.5 | 37 |
National Institutes of Health
| Assay Description
Inhibition assay using NAD synthetase. |
J Biol Chem 283: 19329-41 (2008)
Article DOI: 10.1074/jbc.M800694200
BindingDB Entry DOI: 10.7270/Q27P8X0W |
More data for this
Ligand-Target Pair | |
Glutamine-dependent NAD(+) synthetase
(Homo sapiens (Human)) | BDBM92600
(CHEMBL419944 | NAD Synthetase Inhibitor, 5)Show SMILES COC(=O)c1cc2ccccc2n1CCCCCCCCCOC(=O)Cc1ccc(cc1)[N+](C)(C)C Show InChI InChI=1S/C30H41N2O4/c1-32(2,3)26-18-16-24(17-19-26)22-29(33)36-21-13-9-7-5-6-8-12-20-31-27-15-11-10-14-25(27)23-28(31)30(34)35-4/h10-11,14-19,23H,5-9,12-13,20-22H2,1-4H3/q+1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.78E+4 | n/a | n/a | n/a | n/a | 8.5 | 37 |
National Institutes of Health
| Assay Description
Inhibition assay using NAD synthetase. |
J Biol Chem 283: 19329-41 (2008)
Article DOI: 10.1074/jbc.M800694200
BindingDB Entry DOI: 10.7270/Q27P8X0W |
More data for this
Ligand-Target Pair | |
Glutamine-dependent NAD(+) synthetase
(Homo sapiens (Human)) | BDBM92599
(CHEMBL263057 | NAD Synthetase Inhibitor, 4)Show SMILES COC(=O)c1cc2cc(OCc3ccccc3)ccc2n1CCCCCCCOC(=O)Cc1ccc(cc1)[N+](C)(C)C Show InChI InChI=1S/C35H43N2O5/c1-37(2,3)30-17-15-27(16-18-30)23-34(38)41-22-12-7-5-6-11-21-36-32-20-19-31(42-26-28-13-9-8-10-14-28)24-29(32)25-33(36)35(39)40-4/h8-10,13-20,24-25H,5-7,11-12,21-23,26H2,1-4H3/q+1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.18E+4 | n/a | n/a | n/a | n/a | 8.5 | 37 |
National Institutes of Health
| Assay Description
Inhibition assay using NAD synthetase. |
J Biol Chem 283: 19329-41 (2008)
Article DOI: 10.1074/jbc.M800694200
BindingDB Entry DOI: 10.7270/Q27P8X0W |
More data for this
Ligand-Target Pair | |
Glutamine-dependent NAD(+) synthetase
(Homo sapiens (Human)) | BDBM92598
(NAD Synthetase Inhibitor, 3)Show SMILES COC(=O)c1cc2cc(OCc3ccccc3)ccc2n1CCCCCCCOC(=O)Cc1ccc[n+](C)c1 Show InChI InChI=1S/C32H37N2O5/c1-33-17-11-14-26(23-33)20-31(35)38-19-10-5-3-4-9-18-34-29-16-15-28(39-24-25-12-7-6-8-13-25)21-27(29)22-30(34)32(36)37-2/h6-8,11-17,21-23H,3-5,9-10,18-20,24H2,1-2H3/q+1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.33E+4 | n/a | n/a | n/a | n/a | 8.5 | 37 |
National Institutes of Health
| Assay Description
Inhibition assay using NAD synthetase. |
J Biol Chem 283: 19329-41 (2008)
Article DOI: 10.1074/jbc.M800694200
BindingDB Entry DOI: 10.7270/Q27P8X0W |
More data for this
Ligand-Target Pair | |
Search and Browse
