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 = 'BDBM50518735'   

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))	BDBM50518735 (CHEMBL4584218) Show SMILES OC(=O)[C@H](CCC(=O)N1CCOCC1)NC(=O)\C=C\c1ccccc1 |r| Show InChI InChI=1S/C18H22N2O5/c21-16(8-6-14-4-2-1-3-5-14)19-15(18(23)24)7-9-17(22)20-10-12-25-13-11-20/h1-6,8,15H,7,9-13H2,(H,19,21)(H,23,24)/b8-6+/t15-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya Citi University Curated by ChEMBL					Assay Description Inhibition of Pin1 (unknown origin) using suc-Ala-Glu-Pro-Phe-pNA as substrate preincubated for 10 mins followed by substrate addition and measured f...				Bioorg Med Chem Lett 29: 353-356 (2019) Article DOI: 10.1016/j.bmcl.2018.12.044 BindingDB Entry DOI: 10.7270/Q27D2ZH0
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