Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'S-methylmethionine--homocysteine S-methyltransferase BHMT2' and Ligand = 'BDBM50395382'   

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
S-methylmethionine--homocysteine S-methyltransferase BHMT2 (Homo sapiens (Human))	BDBM50395382 (CHEMBL2164724) Show SMILES CC(CCSCC[C@H](N)C(O)=O)CCC(N)C(O)=O |r| Show InChI InChI=1S/C12H24N2O4S/c1-8(2-3-9(13)11(15)16)4-6-19-7-5-10(14)12(17)18/h8-10H,2-7,13-14H2,1H3,(H,15,16)(H,17,18)/t8?,9?,10-/m0/s1	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	77	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Academy of Sciences of the Czech Republic Curated by ChEMBL					Assay Description Competitive inhibition of recombinant human BHMT2 expressed in Escherichia coli BL31(DE3) by Dixon plot method in presence of D,L-homocysteine				J Med Chem 55: 6822-31 (2012) Article DOI: 10.1021/jm300571h BindingDB Entry DOI: 10.7270/Q2BV7HSH
					More data for this Ligand-Target Pair
S-methylmethionine--homocysteine S-methyltransferase BHMT2 (Homo sapiens (Human))	BDBM50395382 (CHEMBL2164724) Show SMILES CC(CCSCC[C@H](N)C(O)=O)CCC(N)C(O)=O |r| Show InChI InChI=1S/C12H24N2O4S/c1-8(2-3-9(13)11(15)16)4-6-19-7-5-10(14)12(17)18/h8-10H,2-7,13-14H2,1H3,(H,15,16)(H,17,18)/t8?,9?,10-/m0/s1	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Academy of Sciences of the Czech Republic Curated by ChEMBL					Assay Description Inhibition of recombinant human BHMT2 expressed in Escherichia coli BL31(DE3)				J Med Chem 55: 6822-31 (2012) Article DOI: 10.1021/jm300571h BindingDB Entry DOI: 10.7270/Q2BV7HSH
					More data for this Ligand-Target Pair