BDBM50038858 2-(1,3-benzothiazol-2-ylmethyl)-1H,2'H,5'H-spiro[isoquinoline-4,3'-pyrrolidin::CHEMBL292486

SMILES: O=C1CC2(C(=O)N1)C(=O)N(Cc1nc3ccccc3s1)C(=O)c1ccccc21

InChI Key: InChIKey=XDZFFOPLWNJUMA-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 = 50038858   

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 (ALR2) (Bos taurus (Cattle))	BDBM50038858 (2-(1,3-benzothiazol-2-ylmethyl)-1H,2'H,5'H-spiro[i...) Show SMILES O=C1CC2(C(=O)N1)C(=O)N(Cc1nc3ccccc3s1)C(=O)c1ccccc21 Show InChI InChI=1S/C20H13N3O4S/c24-15-9-20(18(26)22-15)12-6-2-1-5-11(12)17(25)23(19(20)27)10-16-21-13-7-3-4-8-14(13)28-16/h1-8H,9-10H2,(H,22,24,26)	PDB GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth-Ayerst Research Curated by ChEMBL					Assay Description In vitro inhibition of aldose reductase activity in a partially purified bovine lens preparation				J Med Chem 37: 2043-58 (1994) Checked by Author BindingDB Entry DOI: 10.7270/Q2BR8STM
					More data for this Ligand-Target Pair