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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Flap endonuclease 1' and Ligand = 'BDBM167111'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Flap endonuclease 1


(Homo sapiens (Human))
BDBM167111
PNG
(US9073876, 195 | US9732093, Compound 195)
Show SMILES OC(=O)Cc1ccc(COc2c(F)c(ccc2C2CCC2)-c2cnc3NCCOc3c2)cc1
Show InChI InChI=1S/C26H25FN2O4/c27-24-20(19-13-22-26(29-14-19)28-10-11-32-22)8-9-21(18-2-1-3-18)25(24)33-15-17-6-4-16(5-7-17)12-23(30)31/h4-9,13-14,18H,1-3,10-12,15H2,(H,28,29)(H,30,31)
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KEGG
PC cid
PC sid
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US Patent
2.20n/an/an/an/an/an/an/an/a



JANSSEN PHARMACEUTICA NV

US Patent




US Patent US9732093 (2017)


BindingDB Entry DOI: 10.7270/Q2NV9MCX
More data for this
Ligand-Target Pair
Flap endonuclease 1


(Homo sapiens (Human))
BDBM167111
PNG
(US9073876, 195 | US9732093, Compound 195)
Show SMILES OC(=O)Cc1ccc(COc2c(F)c(ccc2C2CCC2)-c2cnc3NCCOc3c2)cc1
Show InChI InChI=1S/C26H25FN2O4/c27-24-20(19-13-22-26(29-14-19)28-10-11-32-22)8-9-21(18-2-1-3-18)25(24)33-15-17-6-4-16(5-7-17)12-23(30)31/h4-9,13-14,18H,1-3,10-12,15H2,(H,28,29)(H,30,31)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
UniChem
US Patent
2.20n/an/an/an/an/an/an/an/a



JANSSEN PHARMACEUTICA NV

US Patent




US Patent US9732093 (2017)


BindingDB Entry DOI: 10.7270/Q2NV9MCX
More data for this
Ligand-Target Pair