| Reaction Details |
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 | Report a problem with these data |
| Target | Phosphotransferase |
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| Ligand | BDBM50138728 |
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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 |
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| Synonyms: | Hexokinase |
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| Type: | PROTEIN |
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| Mol. Mass.: | 52180.94 |
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| Organism: | Trypanosoma cruzi |
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| Description: | ChEMBL_330068 |
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| Residue: | 471 |
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| Sequence: | MSARLNNLLQHIAVKDKDSDTMRHLKQRMALASLANQFTVGKDHLKQLMLYMVHQMIEGL
EGRESTLRMLPSYVYKTDPSKATGVFYALDLGGTNFRVLRVTCKEGRVADRVDAKFVIPQ
QALQGTAEDLFGFIAQSVKKMMEQKAPEDLNRTVPLGFTFSFPTEQKGVDHGFLIKWTKG
FSTRGVEGKDVVELLQKALKRMEVKVKVVALCNDTVGTLITNYFFDPDTQVGVIIGTGSN
ACYFEDAYAVTKEPSVAARGTTQTPINMECGNFDSKYKFVLPVTAYDEAMDAVTPNRNFQ
TQEKMVSGMYLGEISRRMIAHLAELHCLPSALASKMAKPWSFETKFMGMISADRMPGLQF
TRQVFQELFQVDVTDVADLHVIRDVCCLVRGRAAQISAMFCSAPLVKTRKEGRATVAIDG
SVFEKTPSFRRLLQQNMNAILGPGCDVTTALARDGSGIGAAFISALVVNDK
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| BDBM50138728 |
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| n/a |
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| Name | BDBM50138728 |
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| Synonyms: | CHEMBL333503 | [(3-tert-butyl-phenyl)-aminomethylene]-1,1-bisphosphonate | [(3-tert-butyl-phenylamino)-phosphono-methyl]-phosphonic acid |
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| Type | Small organic molecule |
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| Emp. Form. | C11H19NO6P2 |
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| Mol. Mass. | 323.2192 |
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| SMILES | CC(C)(C)c1cccc(NC(P(O)(O)=O)P(O)(O)=O)c1 |
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| Structure | 
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