BDBM50170732 CHEMBL191037::[1-((S)-2-Carbamoyl-pyrrolidine-1-carbonyl)-4-((S)-2-hydroxy-3,4-dioxo-cyclobut-1-enylamino)-butyl]-carbamic acid 9H-fluoren-9-ylmethyl ester

SMILES: NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNc1c(O)c(=O)c1=O)NC(=O)OCC1c2ccccc2-c2ccccc12

InChI Key: InChIKey=DWHNQISEDNCHIQ-VXKWHMMOSA-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 = 50170732   

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))	BDBM50170732 (CHEMBL191037 | [1-((S)-2-Carbamoyl-pyrrolidine-1-c...) Show SMILES NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNc1c(O)c(=O)c1=O)NC(=O)OCC1c2ccccc2-c2ccccc12 Show InChI InChI=1S/C29H30N4O7/c30-27(37)22-12-6-14-33(22)28(38)21(11-5-13-31-23-24(34)26(36)25(23)35)32-29(39)40-15-20-18-9-3-1-7-16(18)17-8-2-4-10-19(17)20/h1-4,7-10,20-22,31,34H,5-6,11-15H2,(H2,30,37)(H,32,39)/t21-,22-/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	9.10E+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