Reaction Details Report a problem with these data
Target
dCTP pyrophosphatase 1
Ligand
BDBM50260234
Substrate
n/a
Meas. Tech.
ChEBML_1693435
IC50
190±n/a nM
Citation
 Llona-Minguez, S; Häggblad, M; Martens, U; Johansson, L; Sigmundsson, K; Lundbäck, T; Loseva, O; Jemth, AS; Lundgren, B; Jensen, AJ; Scobie, M; Helleday, T Diverse heterocyclic scaffolds as dCTP pyrophosphatase 1 inhibitors. Part 2: Pyridone- and pyrimidinone-derived systems. Bioorg Med Chem Lett 27:3219-3225 (2017) [PubMed]  Article 
Target
Name:
dCTP pyrophosphatase 1
Synonyms:
DCTP1_HUMAN | DCTPP1 | Deoxycytidine-triphosphatase 1 | XTP3TPA | dCTP pyrophosphatase 1 | dCTP pyrophosphatase 1 (DCTPP1)
Type:
Protein
Mol. Mass.:
18673.58
Organism:
Homo sapiens (Human)
Description:
Q9H773
Residue:
170
Sequence:
MSVAGGEIRGDTGGEDTAAPGRFSFSPEPTLEDIRRLHAEFAAERDWEQFHQPRNLLLALVGEVGELAELFQWKTDGEPGPQGWSPRERAALQEELSDVLIYLVALAARCRVDLPLAVLSKMDINRRRYPAHLARSSSRKYTELPHGAISEDQAVGPADIPCDSTGQTST
  
Inhibitor
Name:
BDBM50260234
Synonyms:
CHEMBL4060941
Type:
Small organic molecule
Emp. Form.:
C17H18ClN3O
Mol. Mass.:
315.797
SMILES:
CCCc1c(C)[nH]c2c(c(C)nn2c1=O)-c1ccc(Cl)cc1
Structure:
Search PDB for entries with ligand similarity: