BDBM50262060 2-((5-chloro-1H-indol-3-yl)methyl)-7-(cyclopropylmethyl)-5-methyl-3-(1-methyl-4-(methylsulfonyl)-1H-imidazol-2-yl)-2H-pyrazolo[3,4-d]pyrimidine-4,6(5H,7H)-dione::CHEMBL511736

SMILES: Cn1cc(nc1-c1n(Cc2c[nH]c3ccc(Cl)cc23)nc2n(CC3CC3)c(=O)n(C)c(=O)c12)S(C)(=O)=O

InChI Key: InChIKey=LOWHJWMOXOSROT-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 = 50262060   

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)	BDBM50262060 (2-((5-chloro-1H-indol-3-yl)methyl)-7-(cyclopropylm...) Show SMILES Cn1cc(nc1-c1n(Cc2c[nH]c3ccc(Cl)cc23)nc2n(CC3CC3)c(=O)n(C)c(=O)c12)S(C)(=O)=O |(18.81,-30.49,;20.35,-30.49,;21.25,-29.25,;22.71,-29.72,;22.71,-31.25,;21.25,-31.74,;20.78,-33.2,;21.69,-34.45,;23.23,-34.45,;24,-35.79,;23.38,-37.19,;24.52,-38.22,;25.85,-37.45,;27.31,-37.92,;28.45,-36.9,;28.13,-35.39,;29.27,-34.36,;26.67,-34.92,;25.54,-35.94,;20.78,-35.71,;19.3,-35.23,;17.96,-36,;17.96,-37.54,;16.62,-38.3,;15.08,-38.31,;15.85,-39.64,;16.63,-35.23,;15.29,-36,;16.63,-33.68,;15.29,-32.91,;17.96,-32.9,;17.96,-31.36,;19.3,-33.68,;23.95,-28.81,;25.19,-27.9,;23.1,-27.52,;24.8,-30.1,)| Show InChI InChI=1S/C24H24ClN7O4S/c1-29-12-18(37(3,35)36)27-22(29)20-19-21(31(10-13-4-5-13)24(34)30(2)23(19)33)28-32(20)11-14-9-26-17-7-6-15(25)8-16(14)17/h6-9,12-13,26H,4-5,10-11H2,1-3H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	31	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
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