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Target
Glutaminase kidney isoform, mitochondrial
Ligand
BDBM50405236
Substrate
n/a
Meas. Tech.
ChEMBL_2264927
IC50
400±n/a nM
Citation
 Lee, EJ; Duggirala, KB; Lee, Y; Yun, MR; Jang, J; Cyriac, R; Jung, ME; Choi, G; Chae, CH; Cho, BC; Lee, K Novel allosteric glutaminase 1 inhibitors with macrocyclic structure activity relationship analysis. Bioorg Med Chem Lett 75:0 (2022) [PubMed]
Target
Name:
Glutaminase kidney isoform, mitochondrial
Synonyms:
GLS | GLS1 | GLSK_HUMAN | Glutaminase 1 | K-glutaminase | KIAA0838 | L-glutamine amidohydrolase
Type:
Protein
Mol. Mass.:
73471.89
Organism:
Homo sapiens (Human)
Description:
O94925
Residue:
669
Sequence:
MMRLRGSGMLRDLLLRSPAGVSATLRRAQPLVTLCRRPRGGGRPAAGPAAAARLHPWWGGGGWPAEPLARGLSSSPSEILQELGKGSTHPQPGVSPPAAPAAPGPKDGPGETDAFGNSEGKELVASGENKIKQGLLPSLEDLLFYTIAEGQEKIPVHKFITALKSTGLRTSDPRLKECMDMLRLTLQTTSDGVMLDKDLFKKCVQSNIVLLTQAFRRKFVIPDFMSFTSHIDELYESAKKQSGGKVADYIPQLAKFSPDLWGVSVCTVDGQRHSTGDTKVPFCLQSCVKPLKYAIAVNDLGTEYVHRYVGKEPSGLRFNKLFLNEDDKPHNPMVNAGAIVVTSLIKQGVNNAEKFDYVMQFLNKMAGNEYVGFSNATFQSERESGDRNFAIGYYLKEKKCFPEGTDMVGILDFYFQLCSIEVTCESASVMAATLANGGFCPITGERVLSPEAVRNTLSLMHSCGMYDFSGQFAFHVGLPAKSGVAGGILLVVPNVMGMMCWSPPLDKMGNSVKGIHFCHDLVSLCNFHNYDNLRHFAKKLDPRREGGDQRVKSVINLLFAAYTGDVSALRRFALSAMDMEQRDYDSRTALHVAAAEGHVEVVKFLLEACKVNPFPKDRWNNTPMDEALHFGHHDVFKILQEYQVQYTPQGDSDNGKENQTVHKNLDGLL
  
Inhibitor
Name:
BDBM50405236
Synonyms:
CHEMBL5288599
Type:
Small organic molecule
Emp. Form.:
C30H32N6O5S
Mol. Mass.:
588.677
SMILES:
O=C1Cc2cccc(OCCOCCOc3cccc(CC(=O)Nc4ccc(CCCCc5nnc(N1)s5)nn4)c3)c2
Structure:
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