Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'G-protein coupled receptor 55' and Ligand = 'BDBM61514'   

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
G-protein coupled receptor 55 (Homo sapiens (Human))	BDBM61514 (2-[3-(2,6-dimethylphenyl)-4-keto-5-(4-pyridylmethy...) Show SMILES Cc1[nH]c2ccccc2c1C(=O)C(C#N)=c1sc(=Cc2ccncc2)c(=O)n1-c1c(C)cccc1C |w:12.13,18.20,(9.64,-4.2,;8.1,-4.2,;7.2,-5.44,;5.75,-4.97,;4.41,-5.74,;3.08,-4.97,;3.08,-3.43,;4.41,-2.66,;5.75,-3.43,;7.2,-2.96,;7.68,-1.5,;6.65,-.35,;9.19,-1.18,;10.22,-2.33,;11.25,-3.47,;9.67,.28,;8.77,1.53,;9.67,2.77,;9.2,4.24,;7.69,4.56,;6.66,3.42,;5.16,3.74,;4.68,5.21,;5.71,6.35,;7.22,6.03,;11.14,2.29,;12.38,3.2,;11.13,.75,;12.61,.33,;12.98,-1.17,;11.87,-2.23,;14.46,-1.59,;15.57,-.53,;15.2,.97,;13.72,1.4,;13.35,2.89,)| Show InChI InChI=1S/C29H22N4O2S/c1-17-7-6-8-18(2)26(17)33-28(35)24(15-20-11-13-31-14-12-20)36-29(33)22(16-30)27(34)25-19(3)32-23-10-5-4-9-21(23)25/h4-15,32H,1-3H3/b24-15-,29-22-	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2348HSG
					More data for this Ligand-Target Pair