Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase Lyn' and Ligand = 'BDBM340111'   

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
Tyrosine-protein kinase Lyn (Homo sapiens (Human))	BDBM340111 ((S,E)-4-(8-amino-3-(1-(4- methoxybut-2-enoyl)pyrro...) Show SMILES COC\C=C\C(=O)N1CCC[C@H]1c1nc(-c2ccc(C(=O)Nc3ccccn3)c(OC)c2)c2c(N)nccn12 |r| Show InChI InChI=1S/C28H29N7O4/c1-38-16-6-9-23(36)34-14-5-7-20(34)27-33-24(25-26(29)31-13-15-35(25)27)18-10-11-19(21(17-18)39-2)28(37)32-22-8-3-4-12-30-22/h3-4,6,8-13,15,17,20H,5,7,14,16H2,1-2H3,(H2,29,31)(H,30,32,37)/b9-6+/t20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a
Merck Sharp & Dohme B.V. US Patent					Assay Description Lyn enzyme activity is measured using the IMAP (immobilized metal ion affinity-based fluorescence polarization) assay as outlined below.Lyn enzyme (M...				US Patent US9758524 (2017) BindingDB Entry DOI: 10.7270/Q2GX4DPQ
					More data for this Ligand-Target Pair
Tyrosine-protein kinase Lyn (Homo sapiens (Human))	BDBM340111 ((S,E)-4-(8-amino-3-(1-(4- methoxybut-2-enoyl)pyrro...) Show SMILES COC\C=C\C(=O)N1CCC[C@H]1c1nc(-c2ccc(C(=O)Nc3ccccn3)c(OC)c2)c2c(N)nccn12 |r| Show InChI InChI=1S/C28H29N7O4/c1-38-16-6-9-23(36)34-14-5-7-20(34)27-33-24(25-26(29)31-13-15-35(25)27)18-10-11-19(21(17-18)39-2)28(37)32-22-8-3-4-12-30-22/h3-4,6,8-13,15,17,20H,5,7,14,16H2,1-2H3,(H2,29,31)(H,30,32,37)/b9-6+/t20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a
Merck Sharp & Dohme B.V. US Patent					Assay Description Lyn enzyme activity is measured using the IMAP (immobilized metal ion affinity-based fluorescence polarization) assay as outlined below.Lyn enzyme (M...				US Patent US10934296 (2021) BindingDB Entry DOI: 10.7270/Q27947T2
					More data for this Ligand-Target Pair
Tyrosine-protein kinase Lyn (Homo sapiens (Human))	BDBM340111 ((S,E)-4-(8-amino-3-(1-(4- methoxybut-2-enoyl)pyrro...) Show SMILES COC\C=C\C(=O)N1CCC[C@H]1c1nc(-c2ccc(C(=O)Nc3ccccn3)c(OC)c2)c2c(N)nccn12 |r| Show InChI InChI=1S/C28H29N7O4/c1-38-16-6-9-23(36)34-14-5-7-20(34)27-33-24(25-26(29)31-13-15-35(25)27)18-10-11-19(21(17-18)39-2)28(37)32-22-8-3-4-12-30-22/h3-4,6,8-13,15,17,20H,5,7,14,16H2,1-2H3,(H2,29,31)(H,30,32,37)/b9-6+/t20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a
Merck Research Laboratories					Assay Description Lyn enzyme (Millipore catalog #14-510), is diluted to 250 mU/mL in KR buffer (10 mM Tris-HCl, 10 mM MgCl2, 0.01% Tween-20, 0.05% NaN3, 1 mM DTT, 2 mM...				J Med Chem 48: 6169-73 (2005) BindingDB Entry DOI: 10.7270/Q20R9RQ4
					More data for this Ligand-Target Pair