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BDBM50385346 CHEMBL2036171

SMILES: CC(C)Cc1ccc(cc1)C(C)c1nc2ccccc2n1Cc1ccc(C)cc1

InChI Key: InChIKey=HDWYBAQHWGYPLM-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50385346   
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))
BDBM50385346
PNG
(CHEMBL2036171)
Show SMILES CC(C)Cc1ccc(cc1)C(C)c1nc2ccccc2n1Cc1ccc(C)cc1
Show InChI InChI=1S/C27H30N2/c1-19(2)17-22-13-15-24(16-14-22)21(4)27-28-25-7-5-6-8-26(25)29(27)18-23-11-9-20(3)10-12-23/h5-16,19,21H,17-18H2,1-4H3
PDB
MMDB

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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 2.90E+3n/an/an/an/an/an/a



Gazi University

Curated by ChEMBL


Assay Description
Inhibition of FLAP in A23187-stimulated human neutrophils assessed as 5-LO product formation preincubated for 15 mins measured after 10 mins


Bioorg Med Chem 20: 3728-41 (2012)


Article DOI: 10.1016/j.bmc.2012.04.048
BindingDB Entry DOI: 10.7270/Q26H4JFM
More data for this
Ligand-Target Pair