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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Reverse transcriptase' and Ligand = 'BDBM50484011'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Reverse transcriptase


(Human immunodeficiency virus 1)
BDBM50484011
PNG
(CHEMBL1802245)
Show SMILES [H][C@@]1(CCc2c(C1)c(C)cc(O)c(=O)c2O)C(C)(O)CNc1ccccc1 |r|
Show InChI InChI=1S/C21H25NO4/c1-13-10-18(23)20(25)19(24)16-9-8-14(11-17(13)16)21(2,26)12-22-15-6-4-3-5-7-15/h3-7,10,14,22,26H,8-9,11-12H2,1-2H3,(H2,23,24,25)/t14-,21?/m0/s1
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.20E+3n/an/an/an/an/an/a



National Cancer Institute-Frederick

Curated by ChEMBL


Assay Description
Inhibition of RNase H activity of his6-tagged HIV1 HXB2 reverse transcriptase p66/p51 expressed in Escherichia coli assessed as substrate cleavage at...


J Med Chem 54: 4462-73 (2011)


Article DOI: 10.1021/jm2000757
BindingDB Entry DOI: 10.7270/Q26T0QH5
More data for this
Ligand-Target Pair