Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 272.2 BDBM50334549

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)	BDBM50334549 (CHEMBL1644505 | [4(5)S]-4(5)-(2-Aminoethyl)-2-[(3-...) Show SMILES NCC[C@H]1CN=C(Nc2cccc(c2)C(F)(F)F)N1 |r,t:5| Show InChI InChI=1S/C12H15F3N4/c13-12(14,15)8-2-1-3-9(6-8)18-11-17-7-10(19-11)4-5-16/h1-3,6,10H,4-5,7,16H2,(H2,17,18,19)/t10-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.31E+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