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Target
Pantetheinase
Ligand
BDBM408838
Substrate
n/a
Meas. Tech.
Enzymatic Assay
IC50
3.30±n/a nM
Citation
 Bosanac, T; Burke, MJ; Cook, BN; Disalvo, DT; Kirrane, Jr., TM; Shen, Y Heteroaromatic compounds as Vanin inhibitors US Patent  US10364255 Publication Date 7/30/2019 
Target
Name:
Pantetheinase
Synonyms:
Pantetheine hydrolase | Tiff66 | VNN1 | VNN1_HUMAN | Vanin-1 | Vascular non-inflammatory molecule 1
Type:
Enzyme Catalytic Domain
Mol. Mass.:
57002.46
Organism:
Homo sapiens (Human)
Description:
O95497
Residue:
513
Sequence:
MTTQLPAYVAILLFYVSRASCQDTFTAAVYEHAAILPNATLTPVSREEALALMNRNLDILEGAITSAADQGAHIIVTPEDAIYGWNFNRDSLYPYLEDIPDPEVNWIPCNNRNRFGQTPVQERLSCLAKNNSIYVVANIGDKKPCDTSDPQCPPDGRYQYNTDVVFDSQGKLVARYHKQNLFMGENQFNVPKEPEIVTFNTTFGSFGIFTCFDILFHDPAVTLVKDFHVDTIVFPTAWMNVLPHLSAVEFHSAWAMGMRVNFLASNIHYPSKKMTGSGIYAPNSSRAFHYDMKTEEGKLLLSQLDSHPSHSAVVNWTSYASSIEALSSGNKEFKGTVFFDEFTFVKLTGVAGNYTVCQKDLCCHLSYKMSENIPNEVYALGAFDGLHTVEGRYYLQICTLLKCKTTNLNTCGDSAETASTRFEMFSLSGTFGTQYVFPEVLLSENQLAPGEFQVSTDGRLFSLKPTSGPVLTVTLFGRLYEKDWASNASSGLTAQARIIMLIVIAPIVCSLSW
  
Inhibitor
Name:
BDBM408838
Synonyms:
US10364255, Ex. 29
Type:
Small organic molecule
Emp. Form.:
C16H22N4O3
Mol. Mass.:
318.3709
SMILES:
C[C@@H]1COc2cc(cnc2N1)C(=O)N1CC[C@@H](C1)N(C)C(C)=O |r|
Structure:
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