Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 571.7 BDBM178968

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
ALK tyrosine kinase receptor (Homo sapiens (Human))	BDBM178968 (US9126931, 210) Show SMILES CC1(C)c2[nH]c3cc(ccc3c2C(=O)c2cc(c(cc12)N1CCC(CC1)N1CCCC1)S(=O)(=O)N1CCCC1)C#N Show InChI InChI=1S/C32H37N5O3S/c1-32(2)25-19-27(36-15-9-22(10-16-36)35-11-3-4-12-35)28(41(39,40)37-13-5-6-14-37)18-24(25)30(38)29-23-8-7-21(20-33)17-26(23)34-31(29)32/h7-8,17-19,22,34H,3-6,9-16H2,1-2H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	8.75	n/a	n/a	n/a	n/a	n/a	n/a
Chugai Seiyaku Kabushiki Kaisha US Patent					Assay Description ALK-inhibiting activity was measured by following an activity of inhibiting phosphorylation by biotinylated peptide (EGPWLEEEEEAYGWMDF). For the dete...				US Patent US9126931 (2015) BindingDB Entry DOI: 10.7270/Q22J69N8
					More data for this Ligand-Target Pair