Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'PAS domain-containing serine/threonine-protein kinase [879-1323]' and Ligand = 'BDBM463453'   

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
PAS domain-containing serine/threonine-protein kinase [879-1323] (Homo sapiens (Human))	BDBM463453 (2-phenyl-3-(4-(quinolin-2-yl)piperazin-1-yl)quinox...) Show SMILES OC(=O)c1ccc2nc(-c3ccccc3)c(nc2c1)N1CCN(CC1)c1ccc2ccccc2n1 Show InChI InChI=1S/C28H23N5O2/c34-28(35)21-10-12-23-24(18-21)31-27(26(30-23)20-7-2-1-3-8-20)33-16-14-32(15-17-33)25-13-11-19-6-4-5-9-22(19)29-25/h1-13,18H,14-17H2,(H,34,35)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	<1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Purified PASK (UniProt #Q96RG2; human recombinant N-terminal GST tagged construct, residues 879-1323) from insect cells (final concentration 5 nM) is...				Citation and Details BindingDB Entry DOI: 10.7270/Q2D79FN2
					More data for this Ligand-Target Pair