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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Arachidonate 5-lipoxygenase-activating protein' and Ligand = 'BDBM145731'   
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
Arachidonate 5-lipoxygenase-activating protein


(Homo sapiens (Human))
BDBM145731
PNG
(US8952177, 85 | US9089569, 85 | US9695149, 85)
Show SMILES Cn1cc(F)c(COc2ccc3nc([C@@H]4CCCC[C@@H]4C(O)=O)n(Cc4ccc(OC(F)(F)F)cc4F)c3c2)n1 |r|
Show InChI InChI=1S/C27H25F5N4O4/c1-35-13-21(29)23(34-35)14-39-16-8-9-22-24(11-16)36(25(33-22)18-4-2-3-5-19(18)26(37)38)12-15-6-7-17(10-20(15)28)40-27(30,31)32/h6-11,13,18-19H,2-5,12,14H2,1H3,(H,37,38)/t18-,19+/m1/s1
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PC sid
UniChem

Similars

US Patent
1.40n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
FLAP-containing membranes were prepared as was a FITC-labeled FLAP modulator (3-(3-(tert-butylthio)-1-(4-chlorobenzyl)-5-(quinolin-2-ylmethoxy)-1H-in...


US Patent US8952177 (2015)


BindingDB Entry DOI: 10.7270/Q2G73CFW
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase-activating protein


(Homo sapiens (Human))
BDBM145731
PNG
(US8952177, 85 | US9089569, 85 | US9695149, 85)
Show SMILES Cn1cc(F)c(COc2ccc3nc([C@@H]4CCCC[C@@H]4C(O)=O)n(Cc4ccc(OC(F)(F)F)cc4F)c3c2)n1 |r|
Show InChI InChI=1S/C27H25F5N4O4/c1-35-13-21(29)23(34-35)14-39-16-8-9-22-24(11-16)36(25(33-22)18-4-2-3-5-19(18)26(37)38)12-15-6-7-17(10-20(15)28)40-27(30,31)32/h6-11,13,18-19H,2-5,12,14H2,1H3,(H,37,38)/t18-,19+/m1/s1
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
1.40n/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 US9695149 (2017)


BindingDB Entry DOI: 10.7270/Q2Q52MSC
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase-activating protein


(Homo sapiens (Human))
BDBM145731
PNG
(US8952177, 85 | US9089569, 85 | US9695149, 85)
Show SMILES Cn1cc(F)c(COc2ccc3nc([C@@H]4CCCC[C@@H]4C(O)=O)n(Cc4ccc(OC(F)(F)F)cc4F)c3c2)n1 |r|
Show InChI InChI=1S/C27H25F5N4O4/c1-35-13-21(29)23(34-35)14-39-16-8-9-22-24(11-16)36(25(33-22)18-4-2-3-5-19(18)26(37)38)12-15-6-7-17(10-20(15)28)40-27(30,31)32/h6-11,13,18-19H,2-5,12,14H2,1H3,(H,37,38)/t18-,19+/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
1.40n/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 US9089569 (2015)


BindingDB Entry DOI: 10.7270/Q23X85DB
More data for this
Ligand-Target Pair