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BDBM267314 3-chloro-5-((1-((5-chloro-6-oxo-1,6-dihydropyridazin-3-yl)methyl)-6-oxo-4-(trifluoromethyl)-1,6-dihydropyrimidin-5-yl)oxy)benzonitrile::US10189831, Example 91::US9718819, 91

SMILES: FC(F)(F)c1ncn(Cc2cc(Cl)c(=O)[nH]n2)c(=O)c1Oc1cc(Cl)cc(c1)C#N

InChI Key: InChIKey=IXCZTGCJPBIWSI-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 = 267314   
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...)
BDBM267314
PNG
(3-chloro-5-((1-((5-chloro-6-oxo-1,6-dihydropyridaz...)
Show SMILES FC(F)(F)c1ncn(Cc2cc(Cl)c(=O)[nH]n2)c(=O)c1Oc1cc(Cl)cc(c1)C#N
Show InChI InChI=1S/C17H8Cl2F3N5O3/c18-9-1-8(5-23)2-11(3-9)30-13-14(17(20,21)22)24-7-27(16(13)29)6-10-4-12(19)15(28)26-25-10/h1-4,7H,6H2,(H,26,28)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem
Article
US Patent
n/an/a 6n/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...)
BDBM267314
PNG
(3-chloro-5-((1-((5-chloro-6-oxo-1,6-dihydropyridaz...)
Show SMILES FC(F)(F)c1ncn(Cc2cc(Cl)c(=O)[nH]n2)c(=O)c1Oc1cc(Cl)cc(c1)C#N
Show InChI InChI=1S/C17H8Cl2F3N5O3/c18-9-1-8(5-23)2-11(3-9)30-13-14(17(20,21)22)24-7-27(16(13)29)6-10-4-12(19)15(28)26-25-10/h1-4,7H,6H2,(H,26,28)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem
Article
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)


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