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Target
Fructose-bisphosphate aldolase
Ligand
BDBM96192
Substrate
n/a
IC50
>1110±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:
BDBM96192
Synonyms:
2-cyano-N'-{[4-(dimethylamino)phenyl]methylene}acetohydrazide | 2-cyano-N-[(Z)-[4-(dimethylamino)benzylidene]amino]acetamide | 2-cyano-N-[(Z)-[4-(dimethylamino)phenyl]methylideneamino]acetamide | 2-cyano-N-[(Z)-[4-(dimethylamino)phenyl]methylideneamino]ethanamide | MLS000720889 | SMR000334240 | cid_5398543
Type:
Small organic molecule
Emp. Form.:
C12H14N4O
Mol. Mass.:
230.2658
SMILES:
CN(C)c1ccc(\C=N/NC(=O)CC#N)cc1
Structure:
Search PDB for entries with ligand similarity: