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Target
Fructose-bisphosphate aldolase
Ligand
BDBM66472
Substrate
n/a
IC50
6610±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:
BDBM66472
Synonyms:
2-[(2,6-dimethylphenyl)carbamothioylamino]-N-(furan-2-ylmethyl)benzamide | 2-[(2,6-dimethylphenyl)thiocarbamoylamino]-N-(2-furfuryl)benzamide | 2-[[(2,6-dimethylanilino)-sulfanylidenemethyl]amino]-N-(2-furanylmethyl)benzamide | MLS000335781 | SMR000253535 | cid_2462681
Type:
Small organic molecule
Emp. Form.:
C21H21N3O2S
Mol. Mass.:
379.475
SMILES:
Cc1cccc(C)c1NC(=S)Nc1ccccc1C(=O)NCc1ccco1
Structure:
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