null

SMILES: CCCCCCCC([O-])=O

InChI Key: InChIKey=WWZKQHOCKIZLMA-UHFFFAOYSA-M

PDB links: 44 PDB IDs match this monomer. 2 PDB IDs contain this monomer as substructures. 2 PDB IDs contain inhibitors having a similarity of 90% to 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 2 hits for monomerid = 23432   

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
Solute carrier family 22 member 11 (Homo sapiens (Human))	BDBM23432 (octanoate | octanoate, 1 | octanoic acid | octanoi...) Show SMILES CCCCCCCC([O-])=O Show InChI InChI=1S/C8H16O2/c1-2-3-4-5-6-7-8(9)10/h2-7H2,1H3,(H,9,10)/p-1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid PDB UniChem Patents Similars	PubMed	2.36E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kyorin University School of Medicine Curated by ChEMBL					Assay Description TP_TRANSPORTER: inhibition of Ochratoxin A uptake in OAT4-expressing S2 cells				Biochim Biophys Acta 1590: 64-75 (2002) BindingDB Entry DOI: 10.7270/Q2DZ09JW
					More data for this Ligand-Target Pair
UDP-3-O-acyl-N-acetylglucosamine deacetylase (Aquifex aeolicus)	BDBM23432 (octanoate | octanoate, 1 | octanoic acid | octanoi...) Show SMILES CCCCCCCC([O-])=O Show InChI InChI=1S/C8H16O2/c1-2-3-4-5-6-7-8(9)10/h2-7H2,1H3,(H,9,10)/p-1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	>1.00E+5	n/a	n/a	n/a	7.0	30
University of San Francisco					Assay Description Ligand binding to A. aeolicus LpxC was assayed by isothermal titration using isothermal microcalorimeter from Microcal, Inc. (Northampton, MA). The e...				Bioorg Med Chem 15: 2617-23 (2007) Article DOI: 10.1016/j.bmc.2007.01.044 BindingDB Entry DOI: 10.7270/Q2TT4P8Q
					More data for this Ligand-Target Pair

Activity Spreadsheet -- ITC Data from BindingDB

Found 5 hits for monomerid = 23432

Cell (A)	Syringe (B)	Cell Links	Syringe Links	Cell + Syr Links	ΔG° kcal/mole	-TΔS° kcal/mole	ΔH° kcal/mole	log K	pH	Temp °C
BDBM4	BDBM23432	MMDB PC cid PC sid PDB	CHEBI KEGG PC cid PC sid PDB		-4.62	0.285	-4.90	3.39	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 124: 12361-71 (2002)
BDBM4	BDBM23432	MMDB PC cid PC sid PDB	CHEBI KEGG PC cid PC sid PDB		-4.66	0.121	-4.78	3.42	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 124: 12361-71 (2002)
BDBM4	BDBM23432	MMDB PC cid PC sid PDB	CHEBI KEGG PC cid PC sid PDB		-4.54	0.313	-4.85	3.33	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 124: 12361-71 (2002)
BDBM4	BDBM23432	MMDB PC cid PC sid PDB	CHEBI KEGG PC cid PC sid PDB		-4.62	0.0498	-4.66	3.39	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 124: 12361-71 (2002)
BDBM4	BDBM23432	MMDB PC cid PC sid PDB	CHEBI KEGG PC cid PC sid PDB		-4.62	0.271	-4.89	3.39	6.90	25
NIST					J Phys Chem B 101: 87-100 (1997)