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BDBM50405113 CHEMBL611910

InChI string: InChI=1S/C20H33N4O8P/c1-2-3-4-5-6-7-8-9-10-14-22-18-15(19(27)23-14)21-12-24(18)20-17(26)16(25)13(32-20)11-31-33(28,29)30/h12-13,16-17,20,25-26H,2-11H2,1H3,(H,22,23,27)(H2,28,29,30)/t13-,16-,17-,20?/m0/s1

SMILES: CCCCCCCCCCc1nc2n(cnc2c(=O)[nH]1)C1O[C@@H](COP(O)(O)=O)[C@H](O)[C@@H]1O

InChI Key: InChIKey=SZFMTNIJNXWXIP-GSVKDTAISA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50405113   
Target
(Institution)
LigandTarget
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


(Escherichia coli (strain K12))
BDBM50405113
PNG
(CHEMBL611910)
Show SMILES CCCCCCCCCCc1nc2n(cnc2c(=O)[nH]1)C1O[C@@H](COP(O)(O)=O)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C20H33N4O8P/c1-2-3-4-5-6-7-8-9-10-14-22-18-15(19(27)23-14)21-12-24(18)20-17(26)16(25)13(32-20)11-31-33(28,29)30/h12-13,16-17,20,25-26H,2-11H2,1H3,(H,22,23,27)(H2,28,29,30)/t13-,16-,17-,20?/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
PubMed
n/an/a 1.50E+5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to inhibit Inosine-5'-monophosphate dehydrogenase isolated from Escherichia coli


J Med Chem 27: 429-32 (1984)

More data for this
Ligand-Target Pair