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Target
D-3-phosphoglycerate dehydrogenase
Ligand
BDBM195606
Substrate
n/a
Meas. Tech.
PHGDH Inhibition Assay
pH
8±n/a
Temperature
298.15±n/a K
IC50
2.5e+3± 6e+2 nM
Comments
extracted
Citation
 Pacold, ME; Brimacombe, KR; Chan, SH; Rohde, JM; Lewis, CA; Swier, LJ; Possemato, R; Chen, WW; Sullivan, LB; Fiske, BP; Cho, S; Freinkman, E; Birsoy, K; Abu-Remaileh, M; Shaul, YD; Liu, CM; Zhou, M; Koh, MJ; Chung, H; Davidson, SM; Luengo, A; Wang, AQ; Xu, X; Yasgar, A; Liu, L; Rai, G; Westover, KD; Vander Heiden, MG; Shen, M; Gray, NS; Boxer, MB; Sabatini, DM A PHGDH inhibitor reveals coordination of serine synthesis and one-carbon unit fate. Nat Chem Biol 12:452-8 (2016) [PubMed]  Article 
Target
Name:
D-3-phosphoglycerate dehydrogenase
Synonyms:
D-3-phosphoglycerate dehydrogenase | PGDH3 | PHGDH | Phosphoglycerate dehydrogenase (PHGDH) | SERA_HUMAN
Type:
Protein
Mol. Mass.:
56650.89
Organism:
Homo sapiens (Human)
Description:
n/a
Residue:
533
Sequence:
MAFANLRKVLISDSLDPCCRKILQDGGLQVVEKQNLSKEELIAELQDCEGLIVRSATKVTADVINAAEKLQVVGRAGTGVDNVDLEAATRKGILVMNTPNGNSLSAAELTCGMIMCLARQIPQATASMKDGKWERKKFMGTELNGKTLGILGLGRIGREVATRMQSFGMKTIGYDPIISPEVSASFGVQQLPLEEIWPLCDFITVHTPLLPSTTGLLNDNTFAQCKKGVRVVNCARGGIVDEGALLRALQSGQCAGAALDVFTEEPPRDRALVDHENVISCPHLGASTKEAQSRCGEEIAVQFVDMVKGKSLTGVVNAQALTSAFSPHTKPWIGLAEALGTLMRAWAGSPKGTIQVITQGTSLKNAGNCLSPAVIVGLLKEASKQADVNLVNAKLLVKEAGLNVTTSHSPAAPGEQGFGECLLAVALAGAPYQAVGLVQGTTPVLQGLNGAVFRPEVPLRRDLPLLLFRTQTSDPAMLPTMIGLLAEAGVRLLSYQTSLVSDGETWHVMGISSLLPSLEAWKQHVTEAFQFHF
  
Inhibitor
Name:
BDBM195606
Synonyms:
NCT-503
Type:
Small organic molecule
Emp. Form.:
C20H23F3N4S
Mol. Mass.:
408.484
SMILES:
Cc1cc(C)nc(NC(=S)N2CCN(Cc3ccc(cc3)C(F)(F)F)CC2)c1
Structure:
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