BDBM50075126 5-Phenyl-1-[(S)-3-(pyrrolidine-1-carbonyl)-3,4-dihydro-1H-isoquinolin-2-yl]-pentan-1-one::CHEMBL422281

SMILES: O=C(CCCCc1ccccc1)N1Cc2ccccc2C[C@H]1C(=O)N1CCCC1

InChI Key: InChIKey=SPXZUFLGMAOBOM-QHCPKHFHSA-N

Data: 1 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50075126   

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
Prolyl endopeptidase (Homo sapiens (Human))	BDBM50075126 (5-Phenyl-1-[(S)-3-(pyrrolidine-1-carbonyl)-3,4-dih...) Show SMILES O=C(CCCCc1ccccc1)N1Cc2ccccc2C[C@H]1C(=O)N1CCCC1 Show InChI InChI=1S/C25H30N2O2/c28-24(15-7-4-12-20-10-2-1-3-11-20)27-19-22-14-6-5-13-21(22)18-23(27)25(29)26-16-8-9-17-26/h1-3,5-6,10-11,13-14,23H,4,7-9,12,15-19H2/t23-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
Université de Lille II Curated by ChEMBL					Assay Description Inhibition of Prolyl endopeptidase				Bioorg Med Chem Lett 9: 437-42 (1999) BindingDB Entry DOI: 10.7270/Q2348JJR
					More data for this Ligand-Target Pair