BDBM50006476 CHEMBL305064::[6-(5,7-Difluoro-benzothiazol-2-ylmethyl)-5-oxo-5,6-dihydro-pyrido[2,3-d]pyridazin-8-yl]-acetic acid

SMILES: OC(=O)Cc1nn(Cc2nc3cc(F)cc(F)c3s2)c(=O)c2cccnc12

InChI Key: InChIKey=KLGRUNSKORTTKE-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 = 50006476   

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 (AR) (Homo sapiens (Human))	BDBM50006476 (CHEMBL305064 | [6-(5,7-Difluoro-benzothiazol-2-ylm...) Show SMILES OC(=O)Cc1nn(Cc2nc3cc(F)cc(F)c3s2)c(=O)c2cccnc12 Show InChI InChI=1S/C17H10F2N4O3S/c18-8-4-10(19)16-12(5-8)21-13(27-16)7-23-17(26)9-2-1-3-20-15(9)11(22-23)6-14(24)25/h1-5H,6-7H2,(H,24,25)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	26	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc Curated by ChEMBL					Assay Description Inhibitory activity against aldose reductase isolated from human placenta				J Med Chem 35: 2155-62 (1992) BindingDB Entry DOI: 10.7270/Q2KK99RR
					More data for this Ligand-Target Pair