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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Arachidonate 5-lipoxygenase-activating protein' and Ligand = 'BDBM50078071'   
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))
BDBM50078071
PNG
(CHEMBL3417516)
Show SMILES CC(C)C(c1noc(n1)-c1cnn(C)c1)c1ccc(cc1)-c1cnc(N)nc1
Show InChI InChI=1S/C20H21N7O/c1-12(2)17(18-25-19(28-26-18)16-10-24-27(3)11-16)14-6-4-13(5-7-14)15-8-22-20(21)23-9-15/h4-12,17H,1-3H3,(H2,21,22,23)
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PC sid
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Article
PubMed
n/an/a 6.20n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Displacement of [125I]-L-691831 from human FLAP expressed in insect SF9 cell membranes after 2 hrs by Topcount analysis


J Med Chem 58: 1669-90 (2015)


Article DOI: 10.1021/jm501185j
BindingDB Entry DOI: 10.7270/Q2SB47GW
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase-activating protein


(Homo sapiens (Human))
BDBM50078071
PNG
(CHEMBL3417516)
Show SMILES CC(C)C(c1noc(n1)-c1cnn(C)c1)c1ccc(cc1)-c1cnc(N)nc1
Show InChI InChI=1S/C20H21N7O/c1-12(2)17(18-25-19(28-26-18)16-10-24-27(3)11-16)14-6-4-13(5-7-14)15-8-22-20(21)23-9-15/h4-12,17H,1-3H3,(H2,21,22,23)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 190n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of FLAP in calcimycin-stimulated human whole blood assessed as inhibition of LTB4 synthesis preincubated for 15 mins followed by calcimyci...


J Med Chem 58: 1669-90 (2015)


Article DOI: 10.1021/jm501185j
BindingDB Entry DOI: 10.7270/Q2SB47GW
More data for this
Ligand-Target Pair