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Target
Fructose-bisphosphate aldolase
Ligand
BDBM49594
Substrate
n/a
IC50
>9983±n/a nM
Citation
 PubChem, PC Fluorescence-based biochemical high throughput dose response assay for inhibitors of the fructose-bisphosphate aldolase (FBA) of M. tuberculosis PubChem Bioassay (2013)[AID] 
Target
Name:
Fructose-bisphosphate aldolase
Synonyms:
ALF_MYCTU | FBP aldolase | FBPA | Fructose-1,6-bisphosphate aldolase | Fructose-1,6-bisphosphate aldolase (FBA) | Fructose-bisphosphate aldolase | Probable fructose-bisphosphate aldolase Fba | fba
Type:
Protein
Mol. Mass.:
36539.01
Organism:
Mycobacterium tuberculosis (strain H37Rv)
Description:
P9WQA3
Residue:
344
Sequence:
MPIATPEVYAEMLGQAKQNSYAFPAINCTSSETVNAAIKGFADAGSDGIIQFSTGGAEFGSGLGVKDMVTGAVALAEFTHVIAAKYPVNVALHTDHCPKDKLDSYVRPLLAISAQRVSKGGNPLFQSHMWDGSAVPIDENLAIAQELLKAAAAAKIILEIEIGVVGGEEDGVANEINEKLYTSPEDFEKTIEALGAGEHGKYLLAATFGNVHGVYKPGNVKLRPDILAQGQQVAAAKLGLPADAKPFDFVFHGGSGSLKSEIEEALRYGVVKMNVDTDTQYAFTRPIAGHMFTNYDGVLKVDGEVGVKKVYDPRSYLKKAEASMSQRVVQACNDLHCAGKSLTH
  
Inhibitor
Name:
BDBM49594
Synonyms:
MLS000567581 | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-thiophenecarboxamide | N-(2,3-dihydro-1,4-benzodioxin-6-yl)thiophene-2-carboxamide | SMR000175835 | Thiophene-2-carboxylic acid (2,3-dihydro-benzo[1,4]dioxin-6-yl)-amide | cid_2810390
Type:
Small organic molecule
Emp. Form.:
C13H11NO3S
Mol. Mass.:
261.296
SMILES:
O=C(Nc1ccc2OCCOc2c1)c1cccs1
Structure:
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