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BDBM303164 US10137210, Example 00024

SMILES: CNc1ccc(cc1I)-c1nc2ccccc2s1

InChI Key: InChIKey=SNSMIKJFCBYXAR-UHFFFAOYSA-N

Data: 1 KI

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 1 hit for monomerid = 303164   
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
Beta amyloid A4 protein


(Homo sapiens (human))
BDBM303164
PNG
(US10137210, Example 00024)
Show SMILES CNc1ccc(cc1I)-c1nc2ccccc2s1
Show InChI InChI=1S/C14H11IN2S/c1-16-11-7-6-9(8-10(11)15)14-17-12-4-2-3-5-13(12)18-14/h2-8,16H,1H3
PDB
MMDB

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KEGG

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DrugBank
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PC cid
PC sid
UniChem
US Patent
4.94n/an/an/an/an/an/an/an/a



The University of Pittsburgh—Of the Commonwealth System of Higher Education

US Patent


Assay Description
Initial competitive binding studies using [3H]CG and synthetic Aβ(1-40) were conducted to determine if CG, ThS and ThT bound to the same site(s)...


US Patent US10137210 (2018)

More data for this
Ligand-Target Pair