BDBM50250904 CHEMBL460657::Elaidinsaeure::elaidic acid::trans-Delta(9)-octadecenoic acid

SMILES: CCCCCCCC\C=C\CCCCCCCC(O)=O

InChI Key: InChIKey=ZQPPMHVWECSIRJ-MDZDMXLPSA-N

Data: 1 IC50  1 Kd

PDB links: 12 PDB IDs match 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 = 50250904   

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
Fatty acid-binding protein 4 (FABP4) (Homo sapiens (Human))	BDBM50250904 (CHEMBL460657 | Elaidinsaeure | elaidic acid | tran...) Show SMILES CCCCCCCC\C=C\CCCCCCCC(O)=O Show InChI InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9+	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PubMed	n/a	n/a	n/a	5.80E+4	n/a	n/a	n/a	n/a	n/a
University of Parma Curated by ChEMBL					Assay Description Binding affinity against Adipocyte lipid binding protein				J Med Chem 45: 2469-83 (2002) BindingDB Entry DOI: 10.7270/Q28916J7
					More data for this Ligand-Target Pair
DNA topoisomerase I (Topo I) (Homo sapiens (Human))	BDBM50250904 (CHEMBL460657 | Elaidinsaeure | elaidic acid | tran...) Show SMILES CCCCCCCC\C=C\CCCCCCCC(O)=O Show InChI InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
University of Puerto Rico Curated by ChEMBL					Assay Description Inhibition of DNA topoisomerase 1 (unknown origin)				J Nat Prod 65: 1715-8 (2002) BindingDB Entry DOI: 10.7270/Q2WW7HFB
					More data for this Ligand-Target Pair