Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 247.2 BDBM50334560

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Nischarin (RAT)	BDBM50334560 (CHEMBL1644516 | [4(5)R]-4(5)-(2-Aminoethyl)-2-(2,3...) Show SMILES NCC[C@@H]1CN=C(N1)C1COc2ccccc2O1 |r,c:5| Show InChI InChI=1S/C13H17N3O2/c14-6-5-9-7-15-13(16-9)12-8-17-10-3-1-2-4-11(10)18-12/h1-4,9,12H,5-8,14H2,(H,15,16)/t9-,12?/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.65E+3	n/a	n/a	n/a	n/a	n/a	n/a
Gdansk University of Technology Curated by ChEMBL					Assay Description Inhibition of Sprague-Dawley rat imidazoline I1 receptor				Bioorg Med Chem 19: 156-67 (2011) Article DOI: 10.1016/j.bmc.2010.11.039 BindingDB Entry DOI: 10.7270/Q2GH9J79
					More data for this Ligand-Target Pair