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BDBM267248 3-chloro-5-((1-((5-(2- fluorophenyl)-6-oxo- 1,6-dihydropyridazin- 3-yl)methyl)-6-oxo- 4-(trifluoromethyl)- 1,6- dihydropyrimidin-5- yl)oxy)benzonitrile::US10189831, Example 25::US9718819, 25

SMILES: Fc1ccccc1-c1cc(Cn2cnc(c(Oc3cc(Cl)cc(c3)C#N)c2=O)C(F)(F)F)n[nH]c1=O

InChI Key: InChIKey=FOADAHQUFUCIAZ-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 267248   
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
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM267248
PNG
(3-chloro-5-((1-((5-(2- fluorophenyl)-6-oxo- 1,6-di...)
Show SMILES Fc1ccccc1-c1cc(Cn2cnc(c(Oc3cc(Cl)cc(c3)C#N)c2=O)C(F)(F)F)n[nH]c1=O
Show InChI InChI=1S/C23H12ClF4N5O3/c24-13-5-12(9-29)6-15(7-13)36-19-20(23(26,27)28)30-11-33(22(19)35)10-14-8-17(21(34)32-31-14)16-3-1-2-4-18(16)25/h1-8,11H,10H2,(H,32,34)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem
Article
US Patent
n/an/a 9n/an/an/an/an/an/a



Merck Sharp & Dohme Corp

US Patent


Assay Description
The heterodimeric nucleic acid substrate used in the HIV-1 RT polymerase reactions was generated by annealing the DNA primer, biotinylated pD500 (Sig...


US Patent US10189831 (2019)


Article DOI: 10.1021/jm049833g
BindingDB Entry DOI: 10.7270/Q2QF8VZJ
More data for this
Ligand-Target Pair
Gag-Pol polyprotein


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM267248
PNG
(3-chloro-5-((1-((5-(2- fluorophenyl)-6-oxo- 1,6-di...)
Show SMILES Fc1ccccc1-c1cc(Cn2cnc(c(Oc3cc(Cl)cc(c3)C#N)c2=O)C(F)(F)F)n[nH]c1=O
Show InChI InChI=1S/C23H12ClF4N5O3/c24-13-5-12(9-29)6-15(7-13)36-19-20(23(26,27)28)30-11-33(22(19)35)10-14-8-17(21(34)32-31-14)16-3-1-2-4-18(16)25/h1-8,11H,10H2,(H,32,34)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem
Article
US Patent
n/an/a 9n/an/an/an/a7.825



Merck Sharp & Dohme Corp

US Patent


Assay Description
The heterodimeric nucleic acid substrate used in the HIV-1 RT polymerase reactions was generated by annealing the DNA primer, biotinylated pD500 (Sig...


US Patent US9718819 (2017)


Article DOI: 10.1021/jm9707028
BindingDB Entry DOI: 10.7270/Q2WM1GDF
More data for this
Ligand-Target Pair