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BDBM1770 2-Amino-6-arylthiobenzonitrile deriv. 2o::2-amino-6-[(2,5-dichlorobenzene)sulfinyl]benzonitrile::CHEMBL292012

SMILES: Nc1cccc(c1C#N)S(=O)c1cc(Cl)ccc1Cl

InChI Key: InChIKey=LMDOMBRWBZIJCZ-UHFFFAOYSA-N

Data: 2 IC50

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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 1770   
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)
BDBM1770
PNG
(2-Amino-6-arylthiobenzonitrile deriv. 2o | 2-amino...)
Show SMILES Nc1cccc(c1C#N)S(=O)c1cc(Cl)ccc1Cl
Show InChI InChI=1S/C13H8Cl2N2OS/c14-8-4-5-10(15)13(6-8)19(18)12-3-1-2-11(17)9(12)7-16/h1-6H,17H2
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 6.17E+3n/an/an/an/an/an/a



University of Perugia

Curated by ChEMBL


Assay Description
Inhibitory concentration against Reverse transcriptase


J Med Chem 48: 3756-67 (2005)


Article DOI: 10.1021/jm049162m
BindingDB Entry DOI: 10.7270/Q2XS5WQ0
More data for this
Ligand-Target Pair
HIV-1 Reverse Transcriptase


(Human immunodeficiency virus type 1)
BDBM1770
PNG
(2-Amino-6-arylthiobenzonitrile deriv. 2o | 2-amino...)
Show SMILES Nc1cccc(c1C#N)S(=O)c1cc(Cl)ccc1Cl
Show InChI InChI=1S/C13H8Cl2N2OS/c14-8-4-5-10(15)13(6-8)19(18)12-3-1-2-11(17)9(12)7-16/h1-6H,17H2
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 6.20E+3n/an/an/an/an/an/a



GlaxoSmithKline



Assay Description
The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.


J Med Chem 44: 1866-82 (2001)


BindingDB Entry DOI: 10.7270/Q2FJ2F09
More data for this
Ligand-Target Pair