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TargetPantetheinase
LigandBDBM480928
Substrate/Competitorn/a
Meas. Tech.ChEMBL_2162817 (CHEMBL5047678)
IC50 25±n/a nM
Citation Casimiro-Garcia, AAllais, CBrennan, AChoi, CDower, GFarley, KAFleming, MFlick, AFrisbie, RKHall, JHepworth, DJones, HKnafels, JDKortum, SLovering, FEMathias, JPMohan, SMorgan, PMParng, CParris, KPullen, NSchlerman, FStansfield, JStrohbach, JWVajdos, FFVincent, FWang, HWang, XWebster, RWright, SW Discovery of a Series of Pyrimidine Carboxamides as Inhibitors of Vanin-1. J Med Chem65:757-784 (2022) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Pantetheinase
Name:Pantetheinase
Synonyms:3.5.1.92 | Pantetheine hydrolase | VNN1_MOUSE | Vanin-1 | Vascular non-inflammatory molecule 1 | Vnn1
Type:PROTEIN
Mol. Mass.:57084.66
Organism:Mus musculus
Description:ChEMBL_120311
Residue:512
Sequence:
MGMSWWLACAAAFSALCVLKASSLDTFLAAVYEHAVILPKDTLLPVSHSEALALMNQNLD
LLEGAIVSAAKQGAHIIVTPEDGIYGVRFTRDTIYPYLEEIPDPQVNWIPCDNPKRFGST
PVQERLSCLAKNNSIYVVANMGDKKPCNTSDSHCPPDGRFQYNTDVVFDSQGKLVARYHK
QNIFMGEDQFNVPMEPEFVTFDTPFGKFGVFTCFDILFHDPAVTLVTEFQVDTILFPTAW
MDVLPHLAAIEFHSAWAMGMGVNFLAANLHNPSRRMTGSGIYAPDSPRVFHYDRKTQEGK
LLFAQLKSHPIHSPVNWTSYASSVESTPTKTQEFQSIVFFDEFTFVELKGIKGNYTVCQN
DLCCHLSYQMSEKRADEVYAFGAFDGLHTVEGQYYLQICILLKCKTTNLRTCGSSVDTAF
TRFEMFSLSGTFGTRYVFPEVLLSEVKLAPGEFQVSSDGRLVSLKPTSGPVLTIGLFGRL
YGKDWASNASSDFIAHSLIIMLIVTPIIHYLC
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM480928
n/a
NameBDBM480928
Synonyms:8-oxa-2-azaspiro[4.5]dec l{2-[(pyrazin-2-ylmethyl)amino]pyrimidin-5-yl}methanone | US10906888, Example 142
TypeSmall organic molecule
Emp. Form.C18H22N6O2
Mol. Mass.354.4063
SMILESO=C(N1CCC2(C1)CCOCC2)c1cnc(NCc2cnccn2)nc1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: