BindingDB logo
myBDB logout

BDBM267391 3-(difluoromethoxy)- 5-((1-((5-(4- fluorophenyl)-6-oxo- 1,6-dihydropyridazin- 3-yl)methyl)-6-oxo- 4-(trifluoromethyl)- 1,6- dihydropyrimidin-5- yl)oxy)benzonitrile::US9718819, 167

SMILES: FC(F)Oc1cc(Oc2c(ncn(Cc3cc(-c4ccc(F)cc4)c(=O)[nH]n3)c2=O)C(F)(F)F)cc(c1)[N+]#[C-]

InChI Key: InChIKey=MDYBCOMMZJKGCC-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 267391   
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...)
BDBM267391
PNG
(3-(difluoromethoxy)- 5-((1-((5-(4- fluorophenyl)-6...)
Show SMILES FC(F)Oc1cc(Oc2c(ncn(Cc3cc(-c4ccc(F)cc4)c(=O)[nH]n3)c2=O)C(F)(F)F)cc(c1)[N+]#[C-]
Show InChI InChI=1S/C24H13F6N5O4/c1-31-14-6-16(9-17(7-14)39-23(26)27)38-19-20(24(28,29)30)32-11-35(22(19)37)10-15-8-18(21(36)34-33-15)12-2-4-13(25)5-3-12/h2-9,11,23H,10H2,(H,34,36)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 6n/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)

More data for this
Ligand-Target Pair