Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Proto-oncogene tyrosine-protein kinase Src' and Ligand = 'BDBM50137576'   

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
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50137576 (3-[1-{3-[3-(4-Hydroxy-piperidin-1-yl)-propyl]-4,5,...) Show SMILES CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN3CCC(O)CC3)c2c1 Show InChI InChI=1S/C26H34N4O4S/c1-27-35(33,34)18-8-9-24-21(15-18)22(26(32)29-24)16-25-20(19-5-2-3-7-23(19)28-25)6-4-12-30-13-10-17(31)11-14-30/h8-9,15-17,27-28,31H,2-7,10-14H2,1H3,(H,29,32)/b22-16-	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
SUGEN, Inc. Curated by ChEMBL					Assay Description Inhibitory activity against cellular Src protein tryrosine kinase using the actin ring assay				Bioorg Med Chem Lett 14: 187-90 (2003) BindingDB Entry DOI: 10.7270/Q2HM57VG
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50137576 (3-[1-{3-[3-(4-Hydroxy-piperidin-1-yl)-propyl]-4,5,...) Show SMILES CNS(=O)(=O)c1ccc2NC(=O)\C(=C/c3[nH]c4CCCCc4c3CCCN3CCC(O)CC3)c2c1 Show InChI InChI=1S/C26H34N4O4S/c1-27-35(33,34)18-8-9-24-21(15-18)22(26(32)29-24)16-25-20(19-5-2-3-7-23(19)28-25)6-4-12-30-13-10-17(31)11-14-30/h8-9,15-17,27-28,31H,2-7,10-14H2,1H3,(H,29,32)/b22-16-	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	900	n/a	n/a	n/a	n/a	n/a	n/a
SUGEN, Inc. Curated by ChEMBL					Assay Description Inhibitory activity against cellular Src protein tryrosine kinase using the actin ring assay				Bioorg Med Chem Lett 14: 187-90 (2003) BindingDB Entry DOI: 10.7270/Q2HM57VG
					More data for this Ligand-Target Pair