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BDBM267387 3-(difluoromethoxy)-5-(6-oxo-1-((6-oxo-1,6-dihydropyridazin-3-yl)methyl)-4-(trifluoromethyl)-1,6-dihydropyrimidin-5-yloxy)benzonitrile::US10189831, Example 163::US9718819, 163

SMILES: FC(F)Oc1cc(Oc2c(ncn(Cc3ccc(=O)[nH]n3)c2=O)C(F)(F)F)cc(c1)C#N

InChI Key: InChIKey=BKLUXGWPTJCJJG-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 = 267387   
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...)
BDBM267387
PNG
(3-(difluoromethoxy)-5-(6-oxo-1-((6-oxo-1,6-dihydro...)
Show SMILES FC(F)Oc1cc(Oc2c(ncn(Cc3ccc(=O)[nH]n3)c2=O)C(F)(F)F)cc(c1)C#N
Show InChI InChI=1S/C18H10F5N5O4/c19-17(20)32-12-4-9(6-24)3-11(5-12)31-14-15(18(21,22)23)25-8-28(16(14)30)7-10-1-2-13(29)27-26-10/h1-5,8,17H,7H2,(H,27,29)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem
Article
US Patent
n/an/a 22n/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...)
BDBM267387
PNG
(3-(difluoromethoxy)-5-(6-oxo-1-((6-oxo-1,6-dihydro...)
Show SMILES FC(F)Oc1cc(Oc2c(ncn(Cc3ccc(=O)[nH]n3)c2=O)C(F)(F)F)cc(c1)C#N
Show InChI InChI=1S/C18H10F5N5O4/c19-17(20)32-12-4-9(6-24)3-11(5-12)31-14-15(18(21,22)23)25-8-28(16(14)30)7-10-1-2-13(29)27-26-10/h1-5,8,17H,7H2,(H,27,29)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem
Article
US Patent
n/an/a 22n/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