Target
2-amino-3-carboxymuconate-6-semialdehyde decarboxylase
Ligand
BDBM261602
Substrate
n/a
Meas. Tech.
ChEMBL_1678430 (CHEMBL4028573)
IC50
151±n/a nM
Citation
 Pellicciari, RLiscio, PGiacchè, NDe Franco, FCarotti, ARobertson, JCialabrini, LKatsyuba, ERaffaelli, NAuwerx, J ?-Amino-?-carboxymuconate-?-semialdehyde Decarboxylase (ACMSD) Inhibitors as Novel Modulators of De Novo Nicotinamide Adenine Dinucleotide (NAD J Med Chem 61:745-759 (2018) [PubMed]  Article 
Target
Name:
2-amino-3-carboxymuconate-6-semialdehyde decarboxylase
Synonyms:
ACMSD | ACMSD_HUMAN | Picolinate carboxylase
Type:
Enzyme Catalytic Domain
Mol. Mass.:
38037.38
Organism:
Homo sapiens (Human)
Description:
Q8TDX5
Residue:
336
Sequence:
MKIDIHSHILPKEWPDLKKRFGYGGWVQLQHHSKGEAKLLKDGKVFRVVRENCWDPEVRIREMDQKGVTVQALSTVPVMFSYWAKPEDTLNLCQLLNNDLASTVVSYPRRFVGLGTLPMQAPELAVKEMERCVKELGFPGVQIGTHVNEWDLNAQELFPVYAAAERLKCSLFVHPWDMQMDGRMAKYWLPWLVGMPAETTIAICSMIMGGVFEKFPKLKVCFAHGGGAFPFTVGRISHGFSMRPDLCAQDNPMNPKKYLGSFYTDALVHDPLSLKLLTDVIGKDKVILGTDYPFPLGELEPGKLIESMEEFDEETKNKLKAGNALAFLGLERKQFE
  
Inhibitor
Name:
BDBM261602
Synonyms:
US10513499, Compound 13 | US11254644, Compound 13 | US9708272, 13
Type:
Small organic molecule
Emp. Form.:
C18H13ClN2O3S
Mol. Mass.:
372.825
SMILES:
OC(=O)c1cccc(CSc2nc(-c3ccccc3)c(Cl)c(=O)[nH]2)c1
Structure:
Search PDB for entries with ligand similarity: