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BDBM50057814 2-{2-[3-(4-Azido-5-hydroxymethyl-tetrahydro-furan-2-yl)-5-methyl-2,6-dioxo-3,6-dihydro-2H-pyrimidin-1-yl]-ethyl}-isoindole-1,3-dione::CHEMBL290236

SMILES: Cc1cn(C2CC(N=[N+]=[N-])C(CO)O2)c(=O)n(CCN2C(=O)c3ccccc3C2=O)c1=O

InChI Key: InChIKey=GMWFEPAWHDJWAF-UHFFFAOYSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50057814   
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
Human immunodeficiency virus type 1 reverse transcriptase


(Human immunodeficiency virus 1)
BDBM50057814
PNG
(2-{2-[3-(4-Azido-5-hydroxymethyl-tetrahydro-furan-...)
Show SMILES Cc1cn(C2CC(N=[N+]=[N-])C(CO)O2)c(=O)n(CCN2C(=O)c3ccccc3C2=O)c1=O
Show InChI InChI=1S/C20H20N6O6/c1-11-9-26(16-8-14(22-23-21)15(10-27)32-16)20(31)25(17(11)28)7-6-24-18(29)12-4-2-3-5-13(12)19(24)30/h2-5,9,14-16,27H,6-8,10H2,1H3
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 1.14E+5n/an/an/an/a



Institut de Chimie des Substances Naturelles CNRS

Curated by ChEMBL


Assay Description
Reverse transcriptase activity was measured in the culture supernatant, concentration that reduces by 50% the HIV produced in the supernatant.


J Med Chem 40: 1550-8 (1997)


Article DOI: 10.1021/jm9600095
BindingDB Entry DOI: 10.7270/Q2TH8KSM
More data for this
Ligand-Target Pair