BindingDB logo
myBDB logout

BDBM267390 3-chloro-5-((1-((5-(4- fluorophenyl)-6-oxo- 1,6-dihydropyridazin- 3-yl)methyl)-4- methyl-6-oxo-1,6- dihydropyrimidin-5- yl)oxy)benzonitrile::US10189831, Example 166::US9718819, 166

SMILES: FC(F)Oc1ncn(Cc2cc(-c3ccc(F)cc3)c(=O)[nH]n2)c(=O)c1Oc1cc(Cl)cc(c1)C#N

InChI Key: InChIKey=JEVSYGZBOKEQFO-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 = 267390   
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...)
BDBM267390
PNG
(3-chloro-5-((1-((5-(4- fluorophenyl)-6-oxo- 1,6-di...)
Show SMILES FC(F)Oc1ncn(Cc2cc(-c3ccc(F)cc3)c(=O)[nH]n2)c(=O)c1Oc1cc(Cl)cc(c1)C#N
Show InChI InChI=1S/C23H13ClF3N5O4/c24-14-5-12(9-28)6-17(7-14)35-19-21(36-23(26)27)29-11-32(22(19)34)10-16-8-18(20(33)31-30-16)13-1-3-15(25)4-2-13/h1-8,11,23H,10H2,(H,31,33)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 3n/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)


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


(Human immunodeficiency virus type 1 group M subtyp...)
BDBM267390
PNG
(3-chloro-5-((1-((5-(4- fluorophenyl)-6-oxo- 1,6-di...)
Show SMILES FC(F)Oc1ncn(Cc2cc(-c3ccc(F)cc3)c(=O)[nH]n2)c(=O)c1Oc1cc(Cl)cc(c1)C#N
Show InChI InChI=1S/C23H13ClF3N5O4/c24-14-5-12(9-28)6-17(7-14)35-19-21(36-23(26)27)29-11-32(22(19)34)10-16-8-18(20(33)31-30-16)13-1-3-15(25)4-2-13/h1-8,11,23H,10H2,(H,31,33)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 3n/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)


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