BDBM92499 Omega-imidazolyl dodecanoic acid

SMILES: OC(=O)CCCCCCCCCCCn1ccnc1

InChI Key: InChIKey=XMSOPSLXOAQSRQ-UHFFFAOYSA-N

Data: 1 Kd

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 1 hit for monomerid = 92499   

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
Cytochrome P450 2E1 (Homo sapiens (Human))	BDBM92499 (Omega-imidazolyl dodecanoic acid) Show SMILES OC(=O)CCCCCCCCCCCn1ccnc1 Show InChI InChI=1S/C15H26N2O2/c18-15(19)10-8-6-4-2-1-3-5-7-9-12-17-13-11-16-14-17/h11,13-14H,1-10,12H2,(H,18,19)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	MMDB PC cid PC sid PDB UniChem Similars	MMDB PDB Article PubMed	n/a	n/a	n/a	1.80E+3	n/a	n/a	n/a	n/a	n/a
The University of Kansas					Assay Description Binding assay using CYP2E1.				J Biol Chem 285: 22282-90 (2010) Article DOI: 10.1074/jbc.M110.109017 BindingDB Entry DOI: 10.7270/Q2FF3QZH
					More data for this Ligand-Target Pair				3D Structure (crystal)