Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Activated CDC42 kinase 1' and Ligand = 'BDBM98209'   

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))	BDBM98209 (US8481733, 21) Show SMILES Nc1nccn2c(nc(-c3ccc(Oc4ccccc4)c(F)c3)c12)C1CCC1 Show InChI InChI=1S/C22H19FN4O/c23-17-13-15(9-10-18(17)28-16-7-2-1-3-8-16)19-20-21(24)25-11-12-27(20)22(26-19)14-5-4-6-14/h1-3,7-14H,4-6H2,(H2,24,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	88	n/a	n/a	n/a	n/a	n/a	n/a
OSI Pharmaceuticals, LLC Curated by ChEMBL					Assay Description Inhibition of ACK1 (unknown origin) by biochemical assay				Bioorg Med Chem Lett 23: 979-84 (2013) Article DOI: 10.1016/j.bmcl.2012.12.042 BindingDB Entry DOI: 10.7270/Q2348MQT
					More data for this Ligand-Target Pair
Activated CDC42 kinase 1 (Homo sapiens (Human))	BDBM98209 (US8481733, 21) Show SMILES Nc1nccn2c(nc(-c3ccc(Oc4ccccc4)c(F)c3)c12)C1CCC1 Show InChI InChI=1S/C22H19FN4O/c23-17-13-15(9-10-18(17)28-16-7-2-1-3-8-16)19-20-21(24)25-11-12-27(20)22(26-19)14-5-4-6-14/h1-3,7-14H,4-6H2,(H2,24,25)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	88	n/a	n/a	n/a	n/a	n/a	n/a
OSI Pharmaceuticals, LLC US Patent					Assay Description AlphaScreen (amplified luminescent proximity homogeneous assay) assay was used to test for ACK1 inhibitory activity.				US Patent US8481733 (2013) BindingDB Entry DOI: 10.7270/Q2XD109J
					More data for this Ligand-Target Pair