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BDBM167143 US9073876, 225::US9732093, Compound 225

SMILES: Fc1c(Oc2ncccn2)c(ccc1-c1cnc2NCCOc2c1)C1CCC1

InChI Key: InChIKey=PAXDJHKGMHZBDS-UHFFFAOYSA-N

Data: 3 KI

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 3 hits for monomerid = 167143   
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
5-lipoxygenase/FLAP


(Homo sapiens (Human))
BDBM167143
PNG
(US9073876, 225 | US9732093, Compound 225)
Show SMILES Fc1c(Oc2ncccn2)c(ccc1-c1cnc2NCCOc2c1)C1CCC1
Show InChI InChI=1S/C21H19FN4O2/c22-18-15(14-11-17-20(26-12-14)23-9-10-27-17)5-6-16(13-3-1-4-13)19(18)28-21-24-7-2-8-25-21/h2,5-8,11-13H,1,3-4,9-10H2,(H,23,26)
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2.5n/an/an/an/an/an/an/an/a



JANSSEN PHARMACEUTICA NV

US Patent


Assay Description
The assay below is used to test the modulatory activity of compounds against FLAP. Human and mouse FLAP-encoding DNA was amplified by polymerase chai...


US Patent US9073876 (2015)


BindingDB Entry DOI: 10.7270/Q28S4NPC
More data for this
Ligand-Target Pair
Flap endonuclease 1


(Homo sapiens (Human))
BDBM167143
PNG
(US9073876, 225 | US9732093, Compound 225)
Show SMILES Fc1c(Oc2ncccn2)c(ccc1-c1cnc2NCCOc2c1)C1CCC1
Show InChI InChI=1S/C21H19FN4O2/c22-18-15(14-11-17-20(26-12-14)23-9-10-27-17)5-6-16(13-3-1-4-13)19(18)28-21-24-7-2-8-25-21/h2,5-8,11-13H,1,3-4,9-10H2,(H,23,26)
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antibodypedia
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PC sid
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US Patent
2.5n/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))
BDBM167143
PNG
(US9073876, 225 | US9732093, Compound 225)
Show SMILES Fc1c(Oc2ncccn2)c(ccc1-c1cnc2NCCOc2c1)C1CCC1
Show InChI InChI=1S/C21H19FN4O2/c22-18-15(14-11-17-20(26-12-14)23-9-10-27-17)5-6-16(13-3-1-4-13)19(18)28-21-24-7-2-8-25-21/h2,5-8,11-13H,1,3-4,9-10H2,(H,23,26)
PDB
MMDB

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KEGG

UniProtKB/SwissProt

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UniChem
US Patent
23.2n/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