BDBM50261913 2-((5-chloro-1-methyl-1H-indol-3-yl)methyl)-7-(cyclopropylmethyl)-5-methyl-3-(2-methyl-5-(methylsulfonyl)furan-3-yl)-2H-pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione::CHEMBL467803

SMILES: Cc1oc(cc1-c1n(Cc2cn(C)c3ccc(Cl)cc23)nc2n(CC3CC3)c(=O)n(C)c(=O)c12)S(C)(=O)=O

InChI Key: InChIKey=XYLNYSDCPRJMBA-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 = 50261913   

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
Glutamate racemase (Helicobacter pylori)	BDBM50261913 (2-((5-chloro-1-methyl-1H-indol-3-yl)methyl)-7-(cyc...) Show SMILES Cc1oc(cc1-c1n(Cc2cn(C)c3ccc(Cl)cc23)nc2n(CC3CC3)c(=O)n(C)c(=O)c12)S(C)(=O)=O |(19.66,-27.53,;21.2,-27.53,;22.1,-26.29,;23.56,-26.76,;23.57,-28.29,;22.1,-28.77,;21.63,-30.24,;22.54,-31.49,;24.08,-31.49,;24.85,-32.82,;24.23,-34.23,;25.38,-35.26,;25.22,-36.79,;26.71,-34.49,;28.16,-34.96,;29.31,-33.93,;28.98,-32.43,;30.12,-31.39,;27.52,-31.96,;26.39,-32.98,;21.63,-32.74,;20.16,-32.27,;18.81,-33.03,;18.81,-34.57,;17.47,-35.34,;15.94,-35.34,;16.71,-36.68,;17.48,-32.26,;16.15,-33.03,;17.48,-30.71,;16.14,-29.95,;18.81,-29.94,;18.81,-28.4,;20.16,-30.71,;24.8,-25.85,;26.13,-25.07,;23.96,-24.56,;25.65,-27.13,)| Show InChI InChI=1S/C26H26ClN5O5S/c1-14-18(10-21(37-14)38(4,35)36)23-22-24(31(11-15-5-6-15)26(34)30(3)25(22)33)28-32(23)13-16-12-29(2)20-8-7-17(27)9-19(16)20/h7-10,12,15H,5-6,11,13H2,1-4H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	57	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca R&D Boston Curated by ChEMBL					Assay Description Inhibition of Helicobacter pylori MurI				Bioorg Med Chem Lett 18: 4716-22 (2008) Article DOI: 10.1016/j.bmcl.2008.06.092 BindingDB Entry DOI: 10.7270/Q2N29WSP
					More data for this Ligand-Target Pair