Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Lysine-specific demethylase 5B' and Ligand = 'BDBM50481827'   

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
Lysine-specific demethylase 5B (Homo sapiens (Human))	BDBM50481827 (CHEMBL5269187) Show SMILES CN1CCN(CCC(=O)NC2C=CC(C=C2)S(N)(=O)=O)CC1 |c:11,14,(1.46,-6.03,;3,-6.03,;3.77,-4.7,;5.31,-4.7,;6.07,-6.04,;7.61,-6.04,;8.38,-7.37,;9.92,-7.37,;10.69,-6.03,;10.69,-8.7,;12.23,-8.7,;13,-10.03,;14.54,-10.03,;15.31,-8.7,;14.54,-7.36,;13,-7.36,;16.85,-8.7,;17.62,-10.04,;16.44,-7.2,;18.33,-8.29,;5.31,-7.38,;3.77,-7.37,)| Show InChI InChI=1S/C14H24N4O3S/c1-17-8-10-18(11-9-17)7-6-14(19)16-12-2-4-13(5-3-12)22(15,20)21/h2-5,12-13H,6-11H2,1H3,(H,16,19)(H2,15,20,21)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB	n/a	n/a	65	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair				3D Structure (crystal)
Lysine-specific demethylase 5B (Homo sapiens (Human))	BDBM50481827 (CHEMBL5269187) Show SMILES CN1CCN(CCC(=O)NC2C=CC(C=C2)S(N)(=O)=O)CC1 |c:11,14,(1.46,-6.03,;3,-6.03,;3.77,-4.7,;5.31,-4.7,;6.07,-6.04,;7.61,-6.04,;8.38,-7.37,;9.92,-7.37,;10.69,-6.03,;10.69,-8.7,;12.23,-8.7,;13,-10.03,;14.54,-10.03,;15.31,-8.7,;14.54,-7.36,;13,-7.36,;16.85,-8.7,;17.62,-10.04,;16.44,-7.2,;18.33,-8.29,;5.31,-7.38,;3.77,-7.37,)| Show InChI InChI=1S/C14H24N4O3S/c1-17-8-10-18(11-9-17)7-6-14(19)16-12-2-4-13(5-3-12)22(15,20)21/h2-5,12-13H,6-11H2,1H3,(H,16,19)(H2,15,20,21)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair				3D Structure (crystal)