Brief Information of the Compound and Protein
Compound Name
7-[(3-hydroxypropyl)sulfanyl]-2-methyl-4-(2-methylpropyl)-6-(naphthalen-1-ylmethyl)-1H,2H,6H-pyrrolo[3,4-d]pyridazin-1-one
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PubChem ID
CID: 5282542
SID: 14783402
Canonical SMILES
CC(C)Cc1nn(C)c(=O)c2c(SCCCO)n(Cc3cccc4ccccc34)cc12
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Compound Formula C25H29N3O2S
Compound Structure
Protein Name
Monocarboxylate transporter 1
Protein Classification
Transporter
>
Electrochemical transporter
>
SLC superfamily of solute carriers
>
SLC16 family of monocarboxylate transporters
Uniprot ID
P53985
Gene Name
SLC16A1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000127 INS-1 Rattus norvegicus (Rat)  1
1
Ki = 0.7079 nM
   TI
   LI
   LO
   TS
CL000001 Jurkat Homo sapiens (Human)  1
1
Ki = 0.0955 nM
   TI
   LI
   LO
   TS
CL000083 MCF-7 Homo sapiens (Human)  1
1
IC50 = 105 nM
   TI
   LI
   LO
   TS
CL000174 Raji Homo sapiens (Human)  1
1
EC50 = 5 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 Ki = 0.1 nM