Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Nuclear receptor coactivator 1' and Ligand = 'BDBM42897'   

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
Nuclear receptor coactivator 1 (Homo sapiens (Human))	BDBM42897 (2-(1,3-dimethyl-2,6-dioxo-7-propan-2-ylpurin-8-yl)...) Show SMILES CC(C)n1c(SCC(=O)NCc2ccco2)nc2n(C)c(=O)n(C)c(=O)c12 Show InChI InChI=1S/C17H21N5O4S/c1-10(2)22-13-14(20(3)17(25)21(4)15(13)24)19-16(22)27-9-12(23)18-8-11-6-5-7-26-11/h5-7,10H,8-9H2,1-4H3,(H,18,23)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	>7.94E+4	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute (TSRI) Assay...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2FT8JGV
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