Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1' and Ligand = 'BDBM50381006'   

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
Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 (Homo sapiens (Human))	BDBM50381006 (CHEMBL2017121) Show SMILES OC(=O)C(=O)Nc1ccc(NC(=O)c2cc3ccc(cc3s2)[N+]([O-])=O)cc1C(=O)c1ccccc1 Show InChI InChI=1S/C24H15N3O7S/c28-21(13-4-2-1-3-5-13)17-11-15(7-9-18(17)26-23(30)24(31)32)25-22(29)20-10-14-6-8-16(27(33)34)12-19(14)35-20/h1-12H,(H,25,29)(H,26,30)(H,31,32)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.99E+3	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Medical Sciences& Peking Union Medical College Curated by ChEMBL					Assay Description Inhibition of His6-tagged human Pin1 expressed in Escherichia coli BL21 using Suc-Ala-Glu-Pro-Phe-4-nitroanilide as substrate after 30 mins by spectr...				Bioorg Med Chem 20: 2992-9 (2012) Article DOI: 10.1016/j.bmc.2012.03.005 BindingDB Entry DOI: 10.7270/Q2CC11Q1
					More data for this Ligand-Target Pair