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BDBM168806 US9079866, 205::US9745328, Compound 205::US9884878, Compound 205

SMILES: CS(=O)(=O)c1ccc(CSc2ccccc2-c2ccc(c(F)c2)-c2cnc(N)cn2)cc1

InChI Key: InChIKey=LVHONBYFXZCGHZ-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 = 168806   
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))
BDBM168806
PNG
(US9079866, 205 | US9745328, Compound 205 | US98848...)
Show SMILES CS(=O)(=O)c1ccc(CSc2ccccc2-c2ccc(c(F)c2)-c2cnc(N)cn2)cc1
Show InChI InChI=1S/C24H20FN3O2S2/c1-32(29,30)18-9-6-16(7-10-18)15-31-23-5-3-2-4-19(23)17-8-11-20(21(25)12-17)22-13-28-24(26)14-27-22/h2-14H,15H2,1H3,(H2,26,28)
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Similars

US Patent
8n/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 US9079866 (2015)


BindingDB Entry DOI: 10.7270/Q2FF3R3Q
More data for this
Ligand-Target Pair
Flap endonuclease 1


(Homo sapiens (Human))
BDBM168806
PNG
(US9079866, 205 | US9745328, Compound 205 | US98848...)
Show SMILES CS(=O)(=O)c1ccc(CSc2ccccc2-c2ccc(c(F)c2)-c2cnc(N)cn2)cc1
Show InChI InChI=1S/C24H20FN3O2S2/c1-32(29,30)18-9-6-16(7-10-18)15-31-23-5-3-2-4-19(23)17-8-11-20(21(25)12-17)22-13-28-24(26)14-27-22/h2-14H,15H2,1H3,(H2,26,28)
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Article
US Patent
8n/an/an/an/an/an/an/an/a



Janssen Pharmaceutica NV

US Patent


Assay Description
The FLAP binding assay is performed in HTRF format (homogeneous time resolved fluorescence). FLAP-containing membranes (1 μg/well final for huma...


US Patent US9745328 (2017)


Article DOI: 10.1021/jm049187l
BindingDB Entry DOI: 10.7270/Q2H13446
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


(Homo sapiens (Human))
BDBM168806
PNG
(US9079866, 205 | US9745328, Compound 205 | US98848...)
Show SMILES CS(=O)(=O)c1ccc(CSc2ccccc2-c2ccc(c(F)c2)-c2cnc(N)cn2)cc1
Show InChI InChI=1S/C24H20FN3O2S2/c1-32(29,30)18-9-6-16(7-10-18)15-31-23-5-3-2-4-19(23)17-8-11-20(21(25)12-17)22-13-28-24(26)14-27-22/h2-14H,15H2,1H3,(H2,26,28)
PDB
MMDB

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Article
US Patent
8n/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 US9884878 (2018)


Article DOI: 10.1021/jm060081v
BindingDB Entry DOI: 10.7270/Q2R78H8P
More data for this
Ligand-Target Pair