BDBM50067385 2'-phenethylspiro[tetrahydro-1H-pyrrole-3,4'-(1',2',3',4'-tetrahydropyrrolo[1,2-a]pyrazine)]-1',2,3',5-tetraone::CHEMBL132245

SMILES: O=C1CC2(C(=O)N1)C(=O)N(CCc1ccccc1)C(=O)c1cccn21

InChI Key: InChIKey=AKJJSPZUJSXSRS-UHFFFAOYSA-N

Data: 1 IC50

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 = 50067385   

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
Aldose reductase (Sus scrofa)	BDBM50067385 (2'-phenethylspiro[tetrahydro-1H-pyrrole-3,4'-(1',2...) Show SMILES O=C1CC2(C(=O)N1)C(=O)N(CCc1ccccc1)C(=O)c1cccn21 Show InChI InChI=1S/C18H15N3O4/c22-14-11-18(16(24)19-14)17(25)20(10-8-12-5-2-1-3-6-12)15(23)13-7-4-9-21(13)18/h1-7,9H,8,10-11H2,(H,19,22,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
Dainippon Pharmaceutical Company, Ltd. Curated by ChEMBL					Assay Description In vitro inhibitory activity against aldose reductase in porcine lens.				J Med Chem 41: 4118-29 (1998) Article DOI: 10.1021/jm9802968 BindingDB Entry DOI: 10.7270/Q20V8BXH
					More data for this Ligand-Target Pair