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BDBM50160721 2-Oxo-heptanedioic acid::2-oxoheptanedioic acid::CHEMBL185075::alpha-ketopimelic acid

SMILES: OC(=O)CCCCC(=O)C(O)=O

InChI Key: InChIKey=HABHUTWTLGRDDU-UHFFFAOYSA-N

Data: 3 KI

PDB links: 1 PDB ID matches this monomer.

Find this compound or compounds like it in BindingDB:
Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50160721   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Dihydrodipicolinate synthase


(Escherichia coli (strain K12))
BDBM50160721
PNG
(2-Oxo-heptanedioic acid | 2-oxoheptanedioic acid |...)
Show SMILES OC(=O)CCCCC(=O)C(O)=O
Show InChI InChI=1S/C7H10O5/c8-5(7(11)12)3-1-2-4-6(9)10/h1-4H2,(H,9,10)(H,11,12)
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Article
PubMed
1.70E+5n/an/an/an/an/an/an/an/a



University of Sydney

Curated by ChEMBL


Assay Description
Binding affinity for Escherichia coli dihydrodipicolinate synthase


Bioorg Med Chem Lett 15: 995-8 (2005)


Article DOI: 10.1016/j.bmcl.2004.12.043
BindingDB Entry DOI: 10.7270/Q26M36BS
More data for this
Ligand-Target Pair
Dihydrodipicolinate synthase


(Escherichia coli (strain K12))
BDBM50160721
PNG
(2-Oxo-heptanedioic acid | 2-oxoheptanedioic acid |...)
Show SMILES OC(=O)CCCCC(=O)C(O)=O
Show InChI InChI=1S/C7H10O5/c8-5(7(11)12)3-1-2-4-6(9)10/h1-4H2,(H,9,10)(H,11,12)
PDB
MMDB

KEGG

UniProtKB/SwissProt

GoogleScholar
Purchase

CHEBI
CHEMBL
KEGG
PC cid
PC sid
PDB
UniChem

Patents


Similars

Article
PubMed
1.70E+5n/an/an/an/an/an/an/an/a



University of Melbourne

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli DHDPS


Bioorg Med Chem 16: 9975-83 (2008)


Article DOI: 10.1016/j.bmc.2008.10.026
BindingDB Entry DOI: 10.7270/Q2FN1748
More data for this
Ligand-Target Pair
4-hydroxy-2-oxoglutarate aldolase, mitochondrial


(Homo sapiens (Human))
BDBM50160721
PNG
(2-Oxo-heptanedioic acid | 2-oxoheptanedioic acid |...)
Show SMILES OC(=O)CCCCC(=O)C(O)=O
Show InChI InChI=1S/C7H10O5/c8-5(7(11)12)3-1-2-4-6(9)10/h1-4H2,(H,9,10)(H,11,12)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
Purchase

CHEBI
CHEMBL
KEGG
PC cid
PC sid
PDB
UniChem

Patents


Similars

Article
PubMed
1.70E+5n/an/an/an/an/an/an/an/a



University of Melbourne

Curated by ChEMBL


Assay Description
Inhibition of dihydrodipicolinate synthase


Bioorg Med Chem Lett 18: 460-3 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.108
BindingDB Entry DOI: 10.7270/Q2QZ29QP
More data for this
Ligand-Target Pair