Found 2 hits Enz. Inhib. hit(s) with Target = 'NAD-dependent protein deacetylase sirtuin-2' and Ligand = 'BDBM50540060' 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)) | BDBM50540060
(CHEMBL4632578)Show SMILES [Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[#7]-c1cc(cc(c1)-[#6](=O)-[#7]-c1cccc(c1)-[#6](=O)-[#7]-c1ccc(c2cc(cc(c12)S([#8-])(=O)=O)S([#8-])(=O)=O)S([#8-])(=O)=O)-[#6](=O)-[#7]-c1cccc(c1)-[#6](=O)-[#7]-c1ccc(c2cc(cc(c12)S([#8-])(=O)=O)S([#8-])(=O)=O)S([#8-])(=O)=O Show InChI InChI=1S/C42H31N5O22S6/c43-24-12-22(41(50)44-25-5-1-3-20(14-25)39(48)46-31-7-9-33(72(58,59)60)29-16-27(70(52,53)54)18-35(37(29)31)74(64,65)66)11-23(13-24)42(51)45-26-6-2-4-21(15-26)40(49)47-32-8-10-34(73(61,62)63)30-17-28(71(55,56)57)19-36(38(30)32)75(67,68)69/h1-19H,43H2,(H,44,50)(H,45,51)(H,46,48)(H,47,49)(H,52,53,54)(H,55,56,57)(H,58,59,60)(H,61,62,63)(H,64,65,66)(H,67,68,69)/p-6 | PDB
MMDB
NCI pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.26E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Sichuan University
Curated by ChEMBL
| Assay Description
Inhibition of sirtuin 2 (unknown origin) |
Eur J Med Chem 161: 48-77 (2019)
Article DOI: 10.1016/j.ejmech.2018.10.028
BindingDB Entry DOI: 10.7270/Q2W380VZ |
More data for this
Ligand-Target Pair | |
NAD-dependent protein deacetylase sirtuin-2
(Homo sapiens (Human)) | BDBM50540060
(CHEMBL4632578)Show SMILES [Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[Na;v0+].[#7]-c1cc(cc(c1)-[#6](=O)-[#7]-c1cccc(c1)-[#6](=O)-[#7]-c1ccc(c2cc(cc(c12)S([#8-])(=O)=O)S([#8-])(=O)=O)S([#8-])(=O)=O)-[#6](=O)-[#7]-c1cccc(c1)-[#6](=O)-[#7]-c1ccc(c2cc(cc(c12)S([#8-])(=O)=O)S([#8-])(=O)=O)S([#8-])(=O)=O Show InChI InChI=1S/C42H31N5O22S6/c43-24-12-22(41(50)44-25-5-1-3-20(14-25)39(48)46-31-7-9-33(72(58,59)60)29-16-27(70(52,53)54)18-35(37(29)31)74(64,65)66)11-23(13-24)42(51)45-26-6-2-4-21(15-26)40(49)47-32-8-10-34(73(61,62)63)30-17-28(71(55,56)57)19-36(38(30)32)75(67,68)69/h1-19H,43H2,(H,44,50)(H,45,51)(H,46,48)(H,47,49)(H,52,53,54)(H,55,56,57)(H,58,59,60)(H,61,62,63)(H,64,65,66)(H,67,68,69)/p-6 | PDB
MMDB
NCI pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.26E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of N-terminal GST-tagged human SIRT2 using ZMAL as substrate incubated for 4 hrs in presence of NAD+ by fluorescence assay |
Citation and Details
Article DOI: 10.1021/acsmedchemlett.0c00559
BindingDB Entry DOI: 10.7270/Q2VQ3698 |
More data for this
Ligand-Target Pair | |
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