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 or PDB:

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)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Dihydrodipicolinate synthase (Escherichia coli (strain K12))	BDBM50160721 (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 B.MOAD GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	1.70E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/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 (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 B.MOAD GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	1.70E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/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 (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 KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	1.70E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/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