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SMILES: CN(C)S(=O)(=O)c1cccc(c1)C(C)(C)NC(=O)c1cc2[nH]c3ccccc3c(=O)c2cc1F

InChI Key: InChIKey=QYSFKRSNBHEERW-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 19284   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Inosine-5'-monophosphate dehydrogenase 2


(Homo sapiens (Human))		BDBM19284
PNG
(Acridone-Based Inhibitor, 4h | N-{2-[3-(dimethylsu...)
Show SMILES CN(C)S(=O)(=O)c1cccc(c1)C(C)(C)NC(=O)c1cc2[nH]c3ccccc3c(=O)c2cc1F
Show InChI InChI=1S/C25H24FN3O4S/c1-25(2,15-8-7-9-16(12-15)34(32,33)29(3)4)28-24(31)18-14-22-19(13-20(18)26)23(30)17-10-5-6-11-21(17)27-22/h5-14H,1-4H3,(H,27,30)(H,28,31)
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MMDB

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Similars
Article
PubMed
n/an/a 7.90n/a 380n/an/a8.025



Bristol-Myers Squibb Company



Assay Description
Inhibition assays were performed using recombinant human IMPDH type 2 and varying concentrations of inhibitor. The production of NADH was monitored b...

J Med Chem 50: 3730-42 (2007)


Article DOI: 10.1021/jm070299x
BindingDB Entry DOI: 10.7270/Q2N58JPV
More data for this
Ligand-Target Pair