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TargetFructose-1,6-bisphosphate aldolase (FBA)
LigandBDBM96159
Substrate/Competitorn/a
IC50>369.98±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]
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Fructose-1,6-bisphosphate aldolase (FBA)
Name:Fructose-1,6-bisphosphate aldolase (FBA)
Synonyms:FBP aldolase | FBPA | Fructose-1,6-bisphosphate aldolase | Fructose-bisphosphate aldolase | Probable fructose-bisphosphate aldolase Fba
Type:Protein
Mol. Mass.:36539.01
Organism:Mycobacterium tuberculosis (strain H37Rv)
Description:P9WQA3
Residue:344
Sequence:
MPIATPEVYAEMLGQAKQNSYAFPAINCTSSETVNAAIKGFADAGSDGIIQFSTGGAEFG
SGLGVKDMVTGAVALAEFTHVIAAKYPVNVALHTDHCPKDKLDSYVRPLLAISAQRVSKG
GNPLFQSHMWDGSAVPIDENLAIAQELLKAAAAAKIILEIEIGVVGGEEDGVANEINEKL
YTSPEDFEKTIEALGAGEHGKYLLAATFGNVHGVYKPGNVKLRPDILAQGQQVAAAKLGL
PADAKPFDFVFHGGSGSLKSEIEEALRYGVVKMNVDTDTQYAFTRPIAGHMFTNYDGVLK
VDGEVGVKKVYDPRSYLKKAEASMSQRVVQACNDLHCAGKSLTH
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BDBM96159
NameBDBM96159
Synonyms:MLS000730301 | N-[3-(diethylamino)propyl]-N'-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]succinamide | N-[3-(diethylamino)propyl]-N'-[4-methyl-2-(4-methyl-1-piperidinyl)-6-quinolinyl]butanediamide | N-[3-(diethylamino)propyl]-N'-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]butanediamide | N-[3-(diethylamino)propyl]-N'-[4-methyl-2-(4-methylpiperidino)-6-quinolyl]succinamide | SMR000308577 | cid_16188839
TypeSmall organic molecule
Emp. Form.C27H41N5O2
Mol. Mass.467.6467
SMILESCCN(CC)CCCNC(=O)CCC(=O)Nc1ccc2nc(cc(C)c2c1)N1CCC(C)CC1
Structure
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n/a
NameBDBM96159
Synonyms:MLS000730301 | N-[3-(diethylamino)propyl]-N'-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]succinamide | N-[3-(diethylamino)propyl]-N'-[4-methyl-2-(4-methyl-1-piperidinyl)-6-quinolinyl]butanediamide | N-[3-(diethylamino)propyl]-N'-[4-methyl-2-(4-methylpiperidin-1-yl)quinolin-6-yl]butanediamide | N-[3-(diethylamino)propyl]-N'-[4-methyl-2-(4-methylpiperidino)-6-quinolyl]succinamide | SMR000308577 | cid_16188839
TypeSmall organic molecule
Emp. Form.C27H41N5O2
Mol. Mass.467.6467
SMILESCCN(CC)CCCNC(=O)CCC(=O)Nc1ccc2nc(cc(C)c2c1)N1CCC(C)CC1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: