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Target
Fructose-bisphosphate aldolase
Ligand
BDBM96214
Substrate
n/a
IC50
>3330±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:
BDBM96214
Synonyms:
(6E)-6-[(1-naphthalenylamino)methylidene]-1-cyclohexa-2,4-dienone | (6E)-6-[(1-naphthylamino)methylene]cyclohexa-2,4-dien-1-one | (6E)-6-[(naphthalen-1-ylamino)methylidene]cyclohexa-2,4-dien-1-one | 2-(Naphthalen-1-yliminomethyl)-phenol | MLS001207287 | SMR000514427 | cid_5393978
Type:
Small organic molecule
Emp. Form.:
C17H13NO
Mol. Mass.:
247.2912
SMILES:
Oc1ccccc1C=Nc1cccc2ccccc12 |w:8.9|
Structure:
Search PDB for entries with ligand similarity: