Found 2 hits in this display 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 |
|---|
Alpha-synuclein
(Homo sapiens (Human)) | BDBM50508768
(CHEMBL4444688 | US11091474, Example 2)Show SMILES CCOCC(Cc1c[nH]c2ccccc12)NC(=O)c1cnc(s1)N1CCN(C)CC1 Show InChI InChI=1S/C22H29N5O2S/c1-3-29-15-17(12-16-13-23-19-7-5-4-6-18(16)19)25-21(28)20-14-24-22(30-20)27-10-8-26(2)9-11-27/h4-7,13-14,17,23H,3,8-12,15H2,1-2H3,(H,25,28) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | 3.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
The fluorescence polarization assay tests the ability of compounds to inhibit the self-aggregation of α-synuclein peptide fragments. Peptides we... |
Citation and Details
BindingDB Entry DOI: 10.7270/Q2MS3WWP |
More data for this
Ligand-Target Pair | |
Alpha-synuclein
(Homo sapiens (Human)) | BDBM50508768
(CHEMBL4444688 | US11091474, Example 2)Show SMILES CCOCC(Cc1c[nH]c2ccccc12)NC(=O)c1cnc(s1)N1CCN(C)CC1 Show InChI InChI=1S/C22H29N5O2S/c1-3-29-15-17(12-16-13-23-19-7-5-4-6-18(16)19)25-21(28)20-14-24-22(30-20)27-10-8-26(2)9-11-27/h4-7,13-14,17,23H,3,8-12,15H2,1-2H3,(H,25,28) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 3.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Drexel University
Curated by ChEMBL
| Assay Description
Inhibition of alpha-synuclein (unknown origin) self-aggregation by fluorescence polarization assay |
ACS Med Chem Lett 10: (2019)
Article DOI: 10.1021/acsmedchemlett.8b00655
BindingDB Entry DOI: 10.7270/Q2RR22HB |
More data for this
Ligand-Target Pair | |