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BDBM1286 3-Aminopyridin-2(1H)-one analogue 6::5-ethyl-6-methyl-3-[(quinolin-3-ylmethyl)amino]-1,2-dihydropyridin-2-one::CHEMBL125510

SMILES: CCc1cc(NCc2cnc3ccccc3c2)c(=O)[nH]c1C

InChI Key: InChIKey=RJDHCISUIBFLAH-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 1286   
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)
BDBM1286
PNG
(3-Aminopyridin-2(1H)-one analogue 6 | 5-ethyl-6-me...)
Show SMILES CCc1cc(NCc2cnc3ccccc3c2)c(=O)[nH]c1C
Show InChI InChI=1S/C18H19N3O/c1-3-14-9-17(18(22)21-12(14)2)20-11-13-8-15-6-4-5-7-16(15)19-10-13/h4-10,20H,3,11H2,1-2H3,(H,21,22)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 339n/an/an/an/an/an/a



Organon Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of HIV-1 reverse transcriptase (HIV-1 RT)


J Med Chem 39: 4065-72 (1996)


Article DOI: 10.1021/jm960058h
BindingDB Entry DOI: 10.7270/Q2Z039F0
More data for this
Ligand-Target Pair
HIV-1 Reverse Transcriptase


(Human immunodeficiency virus type 1)
BDBM1286
PNG
(3-Aminopyridin-2(1H)-one analogue 6 | 5-ethyl-6-me...)
Show SMILES CCc1cc(NCc2cnc3ccccc3c2)c(=O)[nH]c1C
Show InChI InChI=1S/C18H19N3O/c1-3-14-9-17(18(22)21-12(14)2)20-11-13-8-15-6-4-5-7-16(15)19-10-13/h4-10,20H,3,11H2,1-2H3,(H,21,22)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 335n/an/an/an/a8.2n/a



Merck Research Laboratories



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 35: 3792-802 (1992)


Article DOI: 10.1021/jm00099a007
BindingDB Entry DOI: 10.7270/Q2GH9G3P
More data for this
Ligand-Target Pair