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SMILES: CC(C)c1nc(SCC(=O)Nc2nc(C)cs2)c2ccccc2n1

InChI Key: InChIKey=OEJSGWNYBKFOOU-UHFFFAOYSA-N

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 = 114430   
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
Major prion protein


(Homo sapiens (Human))		BDBM114430
PNG
(2-(2-Isopropyl-quinazolin-4-ylsulfanyl)-N-(4-methy...)
Show SMILES CC(C)c1nc(SCC(=O)Nc2nc(C)cs2)c2ccccc2n1
Show InChI InChI=1S/C17H18N4OS2/c1-10(2)15-19-13-7-5-4-6-12(13)16(21-15)23-9-14(22)20-17-18-11(3)8-24-17/h4-8,10H,9H2,1-3H3,(H,18,20,22)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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DrugBank
antibodypedia
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PC cid
PC sid
UniChem

Similars
PCBioAssay
n/an/a 2.05E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...

PubChem Bioassay (2014)


BindingDB Entry DOI: 10.7270/Q2HM573M
More data for this
Ligand-Target Pair