BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Reverse transcriptase protein' and Ligand = 'BDBM50485779'   
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 protein


(Human immunodeficiency virus 1)
BDBM50485779
PNG
(CHEMBL2163850)
Show SMILES Cc1cc(C)cc(c1)S(=O)(=O)c1c([nH]c2ccc(Cl)cc12)C(=O)NCc1ccc(cc1)C#N
Show InChI InChI=1S/C25H20ClN3O3S/c1-15-9-16(2)11-20(10-15)33(31,32)24-21-12-19(26)7-8-22(21)29-23(24)25(30)28-14-18-5-3-17(13-27)4-6-18/h3-12,29H,14H2,1-2H3,(H,28,30)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>4n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of HIV1 reverse transcriptase L100I mutant RNA-dependent DNA polymerase activity using poly(rA)/oligo(dT)10:1 and [3H]-dTTP substrate


J Med Chem 55: 6634-8 (2012)


Article DOI: 10.1021/jm300477h
BindingDB Entry DOI: 10.7270/Q24T6N7D
More data for this
Ligand-Target Pair
Reverse transcriptase protein


(Human immunodeficiency virus 1)
BDBM50485779
PNG
(CHEMBL2163850)
Show SMILES Cc1cc(C)cc(c1)S(=O)(=O)c1c([nH]c2ccc(Cl)cc12)C(=O)NCc1ccc(cc1)C#N
Show InChI InChI=1S/C25H20ClN3O3S/c1-15-9-16(2)11-20(10-15)33(31,32)24-21-12-19(26)7-8-22(21)29-23(24)25(30)28-14-18-5-3-17(13-27)4-6-18/h3-12,29H,14H2,1-2H3,(H,28,30)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>10n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of HIV1 reverse transcriptase K103N mutant RNA-dependent DNA polymerase activity using poly(rA)/oligo(dT)10:1 and [3H]-dTTP substrate


J Med Chem 55: 6634-8 (2012)


Article DOI: 10.1021/jm300477h
BindingDB Entry DOI: 10.7270/Q24T6N7D
More data for this
Ligand-Target Pair