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TargetBifunctional methylenetetrahydrofolate dehydrogenase/cyclohydrolase, mitochondrial
LigandBDBM581311
Substrate/Competitorn/a
Meas. Tech.Inhibition of MTHFD2
IC50 44.0±n/a nM
Citation Bengtsson, CBorhade, SHaraldsson, MHelleday, THenriksson, MHoman, EPaulin, CSandberg, LScobie, MStenmark, PVallin, K 2,6-diamino-3,4-dihydropyrimidin-4-one derivatives and use thereof in therapy US Patent US11504368 Publication Date 11/22/2022
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Bifunctional methylenetetrahydrofolate dehydrogenase/cyclohydrolase, mitochondrial
Name:Bifunctional methylenetetrahydrofolate dehydrogenase/cyclohydrolase, mitochondrial
Synonyms:Bifunctional methylenetetrahydrofolate dehydrogenase/cyclohydrolase, mitochondrial | MTDC_HUMAN | MTHFD2 | Methenyltetrahydrofolate cyclohydrolase | NAD-dependent methylenetetrahydrofolate dehydrogenase | NMDMC
Type:PROTEIN
Mol. Mass.:37904.22
Organism:Homo sapiens (Human)
Description:ChEMBL_109900
Residue:350
Sequence:
MAATSLMSALAARLLQPAHSCSLRLRPFHLAAVRNEAVVISGRKLAQQIKQEVRQEVEEW
VASGNKRPHLSVILVGENPASHSYVLNKTRAAAVVGINSETIMKPASISEEELLNLINKL
NNDDNVDGLLVQLPLPEHIDERRICNAVSPDKDVDGFHVINVGRMCLDQYSMLPATPWGV
WEIIKRTGIPTLGKNVVVAGRSKNVGMPIAMLLHTDGAHERPGGDATVTISHRYTPKEQL
KKHTILADIVISAAGIPNLITADMIKEGAAVIDVGINRVHDPVTAKPKLVGDVDFEGVRQ
KAGYITPVPGGVGPMTVAMLMKNTIIAAKKVLRLEEREVLKSKELGVATN
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BDBM581311
n/a
NameBDBM581311
Synonyms:(2S)-2-({5-[2-(2,4-diamino-6-oxo- 1,6-dihydropyrimidin-5- yl)acetamido]-6-methoxypyridin-2- yl}formamido)pentanedioic acid | US11504368, Example 29
TypeSmall organic molecule
Emp. Form.C18H21N7O8
Mol. Mass.463.4014
SMILESCOc1nc(ccc1NC(=O)Cc1c(N)nc(N)[nH]c1=O)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r|
Structure
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