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BDBM145796 US8952177, 152::US9089569, 152::US9695149, 152

SMILES: Cc1ccc(COc2ccc3nc(C4CCCC[C@H]4C(O)=O)n(Cc4ccc(cc4)N4CCC(F)(F)C4)c3c2)nc1

InChI Key: InChIKey=MLQGMCQDBHQSEN-SSYAZFEXSA-N

Data: 3 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 145796   
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-activating protein (FLAP)


(Homo sapiens (Human))
BDBM145796
PNG
(US8952177, 152 | US9089569, 152 | US9695149, 152)
Show SMILES Cc1ccc(COc2ccc3nc(C4CCCC[C@H]4C(O)=O)n(Cc4ccc(cc4)N4CCC(F)(F)C4)c3c2)nc1 |r|
Show InChI InChI=1S/C32H34F2N4O3/c1-21-6-9-23(35-17-21)19-41-25-12-13-28-29(16-25)38(30(36-28)26-4-2-3-5-27(26)31(39)40)18-22-7-10-24(11-8-22)37-15-14-32(33,34)20-37/h6-13,16-17,26-27H,2-5,14-15,18-20H2,1H3,(H,39,40)/t26?,27-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
2.40n/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
5-lipoxygenase/FLAP


(Homo sapiens (Human))
BDBM145796
PNG
(US8952177, 152 | US9089569, 152 | US9695149, 152)
Show SMILES Cc1ccc(COc2ccc3nc(C4CCCC[C@H]4C(O)=O)n(Cc4ccc(cc4)N4CCC(F)(F)C4)c3c2)nc1 |r|
Show InChI InChI=1S/C32H34F2N4O3/c1-21-6-9-23(35-17-21)19-41-25-12-13-28-29(16-25)38(30(36-28)26-4-2-3-5-27(26)31(39)40)18-22-7-10-24(11-8-22)37-15-14-32(33,34)20-37/h6-13,16-17,26-27H,2-5,14-15,18-20H2,1H3,(H,39,40)/t26?,27-/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
2.40n/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
5-lipoxygenase/FLAP


(Homo sapiens (Human))
BDBM145796
PNG
(US8952177, 152 | US9089569, 152 | US9695149, 152)
Show SMILES Cc1ccc(COc2ccc3nc(C4CCCC[C@H]4C(O)=O)n(Cc4ccc(cc4)N4CCC(F)(F)C4)c3c2)nc1 |r|
Show InChI InChI=1S/C32H34F2N4O3/c1-21-6-9-23(35-17-21)19-41-25-12-13-28-29(16-25)38(30(36-28)26-4-2-3-5-27(26)31(39)40)18-22-7-10-24(11-8-22)37-15-14-32(33,34)20-37/h6-13,16-17,26-27H,2-5,14-15,18-20H2,1H3,(H,39,40)/t26?,27-/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
2.40n/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