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SMILES: Cc1sc(cc1CCCCc1cc2c(nc(N)[nH]c2=O)[nH]1)C(=O)N[C@@H](CCC(O)=O)C(O)=O

InChI Key: InChIKey=HNWBLBBIBWGFBP-AWEZNQCLSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 192709   
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
Trifunctional purine biosynthetic protein adenosine-3


(Homo sapiens (Human))		BDBM192709
PNG
(AGF117)
Show SMILES Cc1sc(cc1CCCCc1cc2c(nc(N)[nH]c2=O)[nH]1)C(=O)N[C@@H](CCC(O)=O)C(O)=O |r|
Show InChI InChI=1S/C21H23N5O6S/c1-10-11(8-15(33-10)19(30)24-14(20(31)32)6-7-16(27)28)4-2-3-5-12-9-13-17(23-12)25-21(22)26-18(13)29/h8-9,14H,2-7H2,1H3,(H,24,30)(H,27,28)(H,31,32)(H2,22,26,29)/t14-/m0/s1
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 7n/an/an/an/a7.5n/a



Duquesne University



Assay Description
GARFTase activity was determined by measuring the rate of 5,8-dideazatetrahydrofolate production in the presence of varying concentrations of antifol...

Biochemistry 55: 4574-82 (2016)


Article DOI: 10.1021/acs.biochem.6b00412
BindingDB Entry DOI: 10.7270/Q270806H
More data for this
Ligand-Target Pair