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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Reverse transcriptase' and Ligand = 'BDBM1732'   
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)
BDBM1732
PNG
(2-Amino-6-arylthiobenzonitrile deriv. 1b | 2-amino...)
Show SMILES COc1ccccc1Sc1cccc(N)c1C#N
Show InChI InChI=1S/C14H12N2OS/c1-17-12-6-2-3-7-14(12)18-13-8-4-5-11(16)10(13)9-15/h2-8H,16H2,1H3
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
n/an/a 2.69E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of HIV-1 reverse transcriptase


Citation and Details

Article DOI: 10.1007/s00044-013-0765-3
BindingDB Entry DOI: 10.7270/Q2W66PQQ
More data for this
Ligand-Target Pair
Reverse transcriptase


(Human immunodeficiency virus 1)
BDBM1732
PNG
(2-Amino-6-arylthiobenzonitrile deriv. 1b | 2-amino...)
Show SMILES COc1ccccc1Sc1cccc(N)c1C#N
Show InChI InChI=1S/C14H12N2OS/c1-17-12-6-2-3-7-14(12)18-13-8-4-5-11(16)10(13)9-15/h2-8H,16H2,1H3
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.70E+6n/an/an/an/an/an/a



Lanzhou University

Curated by ChEMBL


Assay Description
Inhibition of HIV1 reverse transcriptase


Eur J Med Chem 44: 2158-71 (2009)


Article DOI: 10.1016/j.ejmech.2008.10.021
BindingDB Entry DOI: 10.7270/Q21R6T9R
More data for this
Ligand-Target Pair