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BDBM50017366 CHEMBL3288275

SMILES: Nc1ccc2C(C(=O)NCc3ccc(F)cc3)C(=O)N(O)C(=O)c2c1

InChI Key: InChIKey=ASPUMZATXCLVBT-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50017366   
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 integrase


(Human immunodeficiency virus 1)
BDBM50017366
PNG
(CHEMBL3288275)
Show SMILES Nc1ccc2C(C(=O)NCc3ccc(F)cc3)C(=O)N(O)C(=O)c2c1
Show InChI InChI=1S/C17H14FN3O4/c18-10-3-1-9(2-4-10)8-20-15(22)14-12-6-5-11(19)7-13(12)16(23)21(25)17(14)24/h1-7,14,25H,8,19H2,(H,20,22)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 110n/an/an/an/an/an/a



Universit£ Lille Nord de France

Curated by ChEMBL


Assay Description
Inhibition of HIV-1 overall integrase activity using 5'-digoxigenin-labeled GACCCTTTTAGTCAGTGTGGAAAATCTCTAGCAGT-3' as substrate after 1 hr by ELISA


J Med Chem 57: 4640-60 (2014)


Article DOI: 10.1021/jm500109z
BindingDB Entry DOI: 10.7270/Q2TQ6335
More data for this
Ligand-Target Pair