Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Activated CDC42 kinase 1' and Ligand = 'BDBM50084454'   

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
Activated CDC42 kinase 1 (Homo sapiens (Human))	BDBM50084454 (CHEMBL3426870) Show SMILES Fc1cccc(Cl)c1NC(=O)c1cnc(Nc2ccc(cc2)N2CCNCC2)nc1NCC1CCCO1 Show InChI InChI=1S/C26H29ClFN7O2/c27-21-4-1-5-22(28)23(21)33-25(36)20-16-31-26(34-24(20)30-15-19-3-2-14-37-19)32-17-6-8-18(9-7-17)35-12-10-29-11-13-35/h1,4-9,16,19,29H,2-3,10-15H2,(H,33,36)(H2,30,31,32,34)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	33	n/a	n/a	n/a	n/a	n/a	n/a
University of South Florida Curated by ChEMBL					Assay Description Inhibition of human ACK1 using EAIYAAPFAKKK peptide substrate by 33P Hotspot assay				J Med Chem 58: 2746-63 (2015) Article DOI: 10.1021/jm501929n BindingDB Entry DOI: 10.7270/Q2H996XC
					More data for this Ligand-Target Pair