Reaction Details Report a problem with these data
Target
dCTP pyrophosphatase 1
Ligand
BDBM50236126
Substrate
n/a
Meas. Tech.
ChEMBL_1658761 (CHEMBL4008373)
IC50
691±n/a nM
Citation
 Llona-Minguez, S; Höglund, A; Wiita, E; Almlöf, I; Mateus, A; Calderón-Montaño, JM; Cazares-Körner, C; Homan, E; Loseva, O; Baranczewski, P; Jemth, AS; Häggblad, M; Martens, U; Lundgren, B; Artursson, P; Lundbäck, T; Jenmalm Jensen, A; Warpman Berglund, U; Scobie, M; Helleday, T Identification of Triazolothiadiazoles as Potent Inhibitors of the dCTP Pyrophosphatase 1. J Med Chem 60:2148-2154 (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:
BDBM50236126
Synonyms:
CHEMBL4084351
Type:
Small organic molecule
Emp. Form.:
C14H10N6S
Mol. Mass.:
294.334
SMILES:
Cc1ccccc1-c1nn2c(nnc2s1)-c1cnccn1
Structure:
Search PDB for entries with ligand similarity: