Brief Information of the Compound and Protein
Compound Name
 Compound Info 
(3R,9S,12S,15S,24S,29aS)-24-((1H-indol-3-yl)methyl)-N-(2-amino-2-oxoethyl)-9-benzyl-12-(4-carbamoylbenzyl)-15-(3-guanidinopropyl)-20-hexyl-1,7,10,13,16,19,22,25-octaoxooctacosahydropyrrolo[2,1-f][1]thia[4,7,10,13,16,19,22,25]octaazacycloheptacosine-3-carboxamide
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 PubChem ID
CID: 168277674
Canonical SMILES
CCCCCCN1CC(=O)N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N2CCC[C@H]2C(=O)N[C@H](C(=O)NCC(N)=O)CSCC(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccc(C(N)=O)cc2)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC1=O
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Compound Formula C58H77N15O11S
Compound Structure
Protein Name
 Protein Info 
Nicotinamide N-methyltransferase
Protein Classification
Enzyme
>
Transferase
Uniprot ID
P40261
Gene Name
NNMT
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293
 Cell Line Info 
Homo sapiens (Human)  1
1
IC50 > 100000 nM
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