Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Dual specificity protein kinase TTK' and Ligand = 'BDBM50533127'   

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
Dual specificity protein kinase TTK (Homo sapiens (Human))	BDBM50533127 (CHEMBL4586082) Show SMILES Cc1cc(ccc1C(=O)NC1CC1)-c1cnn2c(NCC3CCOCC3)cc(N[C@H]3CCC[C@H]3O)nc12 |r| Show InChI InChI=1S/C28H36N6O3/c1-17-13-19(5-8-21(17)28(36)31-20-6-7-20)22-16-30-34-26(29-15-18-9-11-37-12-10-18)14-25(33-27(22)34)32-23-3-2-4-24(23)35/h5,8,13-14,16,18,20,23-24,29,35H,2-4,6-7,9-12,15H2,1H3,(H,31,36)(H,32,33)/t23-,24+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.70	n/a	n/a	n/a	n/a	n/a	n/a
EntreMed Inc. Curated by ChEMBL					Assay Description Inhibition of full length recombinant N-terminal GST-tagged and sumo-tagged human TTK (1 to 275 residues) expressed in Escherichia coli pre-incubated...				ACS Med Chem Lett 7: 671-5 (2016) Article DOI: 10.1021/acsmedchemlett.5b00485 BindingDB Entry DOI: 10.7270/Q2K35Z46
					More data for this Ligand-Target Pair
Dual specificity protein kinase TTK (Homo sapiens (Human))	BDBM50533127 (CHEMBL4586082) Show SMILES Cc1cc(ccc1C(=O)NC1CC1)-c1cnn2c(NCC3CCOCC3)cc(N[C@H]3CCC[C@H]3O)nc12 |r| Show InChI InChI=1S/C28H36N6O3/c1-17-13-19(5-8-21(17)28(36)31-20-6-7-20)22-16-30-34-26(29-15-18-9-11-37-12-10-18)14-25(33-27(22)34)32-23-3-2-4-24(23)35/h5,8,13-14,16,18,20,23-24,29,35H,2-4,6-7,9-12,15H2,1H3,(H,31,36)(H,32,33)/t23-,24+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.70	n/a	n/a	n/a	n/a	n/a	n/a
EntreMed Inc. Curated by ChEMBL					Assay Description Inhibition of full length recombinant N-terminal GST-tagged and sumo-tagged human TTK (1 to 275 residues) expressed in Escherichia coli pre-incubated...				ACS Med Chem Lett 7: 671-5 (2016) Article DOI: 10.1021/acsmedchemlett.5b00485 BindingDB Entry DOI: 10.7270/Q2K35Z46
					More data for this Ligand-Target Pair