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BDBM170547 US9085549, 63

SMILES: Oc1ccc(cc1O)-c1ccc(s1)-c1cc(O)c(O)c(O)c1

InChI Key: InChIKey=MFNMURUUYQGPJF-UHFFFAOYSA-N

Data: 1 KI  1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 170547   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Alpha-synuclein


(Homo sapiens (Human))
BDBM170547
PNG
(US9085549, 63)
Show SMILES Oc1ccc(cc1O)-c1ccc(s1)-c1cc(O)c(O)c(O)c1
Show InChI InChI=1S/C16H12O5S/c17-10-2-1-8(5-11(10)18)14-3-4-15(22-14)9-6-12(19)16(21)13(20)7-9/h1-7,17-21H
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
283n/an/an/an/an/an/a7.4n/a



PROTEOTECH INC

US Patent


Assay Description
The compounds prepared in the preceding examples were found to bind with high affinity to α-synuclein aggregates/fibrils that are found in the h...


US Patent US9085549 (2015)


BindingDB Entry DOI: 10.7270/Q2WD3Z9K
More data for this
Ligand-Target Pair
Tau


(Homo sapiens (Human))
BDBM170547
PNG
(US9085549, 63)
Show SMILES Oc1ccc(cc1O)-c1ccc(s1)-c1cc(O)c(O)c(O)c1
Show InChI InChI=1S/C16H12O5S/c17-10-2-1-8(5-11(10)18)14-3-4-15(22-14)9-6-12(19)16(21)13(20)7-9/h1-7,17-21H
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 1.01E+4n/an/an/an/an/an/a



PROTEOTECH INC

US Patent


Assay Description
The Thio S fluorometry assay as a primary screening method to identify tau protein aggregation inhibitors from our small molecule library. Aggregated...


US Patent US9085549 (2015)


BindingDB Entry DOI: 10.7270/Q2WD3Z9K
More data for this
Ligand-Target Pair