Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'E3 ubiquitin-protein ligase XIAP' and Ligand = 'BDBM44354'   

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
E3 ubiquitin-protein ligase XIAP (Homo sapiens (Human))	BDBM44354 (MLS-0425210.0001 | benzyl N-[(5S)-5-[[(2S)-3-methy...) Show SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCNC(=O)OCc1ccccc1)C(=O)NNc1ccccc1 Show InChI InChI=1S/C29H42N6O5/c1-20(2)25(33-26(36)21(3)30-4)28(38)32-24(27(37)35-34-23-15-9-6-10-16-23)17-11-12-18-31-29(39)40-19-22-13-7-5-8-14-22/h5-10,13-16,20-21,24-25,30,34H,11-12,17-19H2,1-4H3,(H,31,39)(H,32,38)(H,33,36)(H,35,37)/t21-,24-,25-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	5.50E+3	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 (2009) BindingDB Entry DOI: 10.7270/Q2FN14KV
					More data for this Ligand-Target Pair
E3 ubiquitin-protein ligase XIAP (Homo sapiens (Human))	BDBM44354 (MLS-0425210.0001 | benzyl N-[(5S)-5-[[(2S)-3-methy...) Show SMILES CN[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCNC(=O)OCc1ccccc1)C(=O)NNc1ccccc1 Show InChI InChI=1S/C29H42N6O5/c1-20(2)25(33-26(36)21(3)30-4)28(38)32-24(27(37)35-34-23-15-9-6-10-16-23)17-11-12-18-31-29(39)40-19-22-13-7-5-8-14-22/h5-10,13-16,20-21,24-25,30,34H,11-12,17-19H2,1-4H3,(H,31,39)(H,32,38)(H,33,36)(H,35,37)/t21-,24-,25-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.90E+4	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 (2009) BindingDB Entry DOI: 10.7270/Q29W0CWK
					More data for this Ligand-Target Pair