Reaction Details |
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Target | Phosphotransferase |
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Ligand | BDBM50173780 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_330068 (CHEMBL865780) |
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IC50 | 3311311214826±n/a nM |
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Citation | Hudock, MP; Sanz-Rodríguez, CE; Song, Y; Chan, JM; Zhang, Y; Odeh, S; Kosztowski, T; Leon-Rossell, A; Concepción, JL; Yardley, V; Croft, SL; Urbina, JA; Oldfield, E Inhibition of Trypanosoma cruzi hexokinase by bisphosphonates. J Med Chem49:215-23 (2006) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Phosphotransferase |
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Name: | Phosphotransferase |
Synonyms: | Hexokinase |
Type: | PROTEIN |
Mol. Mass.: | 52180.94 |
Organism: | Trypanosoma cruzi |
Description: | ChEMBL_330068 |
Residue: | 471 |
Sequence: | MSARLNNLLQHIAVKDKDSDTMRHLKQRMALASLANQFTVGKDHLKQLMLYMVHQMIEGL
EGRESTLRMLPSYVYKTDPSKATGVFYALDLGGTNFRVLRVTCKEGRVADRVDAKFVIPQ
QALQGTAEDLFGFIAQSVKKMMEQKAPEDLNRTVPLGFTFSFPTEQKGVDHGFLIKWTKG
FSTRGVEGKDVVELLQKALKRMEVKVKVVALCNDTVGTLITNYFFDPDTQVGVIIGTGSN
ACYFEDAYAVTKEPSVAARGTTQTPINMECGNFDSKYKFVLPVTAYDEAMDAVTPNRNFQ
TQEKMVSGMYLGEISRRMIAHLAELHCLPSALASKMAKPWSFETKFMGMISADRMPGLQF
TRQVFQELFQVDVTDVADLHVIRDVCCLVRGRAAQISAMFCSAPLVKTRKEGRATVAIDG
SVFEKTPSFRRLLQQNMNAILGPGCDVTTALARDGSGIGAAFISALVVNDK
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BDBM50173780 |
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n/a |
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Name | BDBM50173780 |
Synonyms: | (2-Adamantan-1-yl-1-hydroxy-1-phosphono-ethyl)-phosphonic acid | CHEMBL199206 |
Type | Small organic molecule |
Emp. Form. | C12H22O7P2 |
Mol. Mass. | 340.2464 |
SMILES | OC(CC12CC3CC(CC(C3)C1)C2)(P(O)(O)=O)P(O)(O)=O |TLB:10:9:12:5.4.6,10:5:12:9.11.8,THB:8:7:4:9.11.10,8:9:4:7.12.6| |
Structure |
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