BDBM50170748 CHEMBL366302::[(S)-1-((S)-2-Carbamoyl-pyrrolidine-1-carbonyl)-5-(2-hydroxy-3,4-dioxo-cyclobut-1-enylamino)-pentyl]-carbamic acid 9H-fluoren-9-ylmethyl ester

SMILES: NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCNc1c(O)c(=O)c1=O)NC(=O)OCC1c2ccccc2-c2ccccc12

InChI Key: InChIKey=PXSMKLZLOBOWEJ-GOTSBHOMSA-N

Data: 1 Kd

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50170748   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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))	BDBM50170748 (CHEMBL366302 | [(S)-1-((S)-2-Carbamoyl-pyrrolidine...) Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCNc1c(O)c(=O)c1=O)NC(=O)OCC1c2ccccc2-c2ccccc12 Show InChI InChI=1S/C30H32N4O7/c31-28(38)23-13-7-15-34(23)29(39)22(12-5-6-14-32-24-25(35)27(37)26(24)36)33-30(40)41-16-21-19-10-3-1-8-17(19)18-9-2-4-11-20(18)21/h1-4,8-11,21-23,32,35H,5-7,12-16H2,(H2,31,38)(H,33,40)/t22-,23-/m0/s1	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	n/a	5.40E+5	n/a	n/a	n/a	n/a	n/a
CNRS-University of Lille 2 UMR 8525 Curated by ChEMBL					Assay Description Dissociation constant for human peptidyl-prolyl cis-trans isomerase NIMA-interacting 1				J Med Chem 48: 4815-23 (2005) Article DOI: 10.1021/jm0500119 BindingDB Entry DOI: 10.7270/Q2542N4Z
					More data for this Ligand-Target Pair