BindingDB logo
myBDB logout

BDBM145726 US8952177, 80::US9089569, 80::US9695149, 80

SMILES: Cc1ccc(COc2ccc3nc(C4CCCCC4)n(Cc4ccc(cc4)-c4ncc(Cl)cn4)c3c2)nc1

InChI Key: InChIKey=UNWDHUIJLMMKMA-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 145726   
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))
BDBM145726
PNG
(US8952177, 80 | US9089569, 80 | US9695149, 80)
Show SMILES Cc1ccc(COc2ccc3nc(C4CCCCC4)n(Cc4ccc(cc4)-c4ncc(Cl)cn4)c3c2)nc1
Show InChI InChI=1S/C31H30ClN5O/c1-21-7-12-26(33-16-21)20-38-27-13-14-28-29(15-27)37(31(36-28)24-5-3-2-4-6-24)19-22-8-10-23(11-9-22)30-34-17-25(32)18-35-30/h7-18,24H,2-6,19-20H2,1H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
3.30n/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
5-lipoxygenase-activating protein (FLAP)


(Homo sapiens (Human))
BDBM145726
PNG
(US8952177, 80 | US9089569, 80 | US9695149, 80)
Show SMILES Cc1ccc(COc2ccc3nc(C4CCCCC4)n(Cc4ccc(cc4)-c4ncc(Cl)cn4)c3c2)nc1
Show InChI InChI=1S/C31H30ClN5O/c1-21-7-12-26(33-16-21)20-38-27-13-14-28-29(15-27)37(31(36-28)24-5-3-2-4-6-24)19-22-8-10-23(11-9-22)30-34-17-25(32)18-35-30/h7-18,24H,2-6,19-20H2,1H3
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
3.30n/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