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3 similar compounds to monomer 50177016

Wt: 378.4
BDBM50177003
Wt: 340.3
BDBM50176999
Wt: 362.2
BDBM50177032

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50177003,50176999,50177032   
Target
(Institution)
LigandTarget
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))
BDBM50177003
PNG
(CHEMBL3813911)
Show SMILES CC(C)CC(=O)C1=C(O)C(CC=C(C)C)=C2O[C@H](C[C@@]2(O)C1=O)C(C)(C)O
Show InChI InChI=1/C21H30O6/c1-11(2)7-8-13-17(23)16(14(22)9-12(3)4)18(24)21(26)10-15(20(5,6)25)27-19(13)21/h7,12,15,23,25-26H,8-10H2,1-6H3/t15-,21-/s2
PDB
MMDB

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PC cid
PC sid
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Similars

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PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



University of Naples Federico II

Curated by ChEMBL


Assay Description
Inhibition of recombinant human 5-LO expressed in Escherichia coli MV1190 cells preincubated for 10 mins followed by addition of arachidonic acid as ...


J Nat Prod 79: 590-7 (2016)

More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.3


(Mus musculus)
BDBM50176999
PNG
(CHEMBL3814333)
Show SMILES COc1c(C(C)=O)c(O)c(OCCCc2ccccc2)c2occc12
Show InChI InChI=1S/C20H20O5/c1-13(21)16-17(22)20(19-15(10-12-25-19)18(16)23-2)24-11-6-9-14-7-4-3-5-8-14/h3-5,7-8,10,12,22H,6,9,11H2,1-2H3
PDB
MMDB

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PC sid
UniChem

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PubMed
n/an/an/an/a 1.00E+3n/an/an/an/a



Monash University (Parkville Campus)

Curated by ChEMBL


Assay Description
Inhibition of mouse Kv1.3 expressed in L929 cells at -80 mV holding potential by whole cell patch-clamp method


J Nat Prod 79: 616-28 (2016)

More data for this
Ligand-Target Pair
PI3-kinase class I


(Homo sapiens (human))
BDBM50177032
PNG
(CHEMBL3814407)
Show SMILES FC(F)(F)c1cc(Nc2nc3ccccc3s2)cc(c1)C(F)(F)F
Show InChI InChI=1S/C15H8F6N2S/c16-14(17,18)8-5-9(15(19,20)21)7-10(6-8)22-13-23-11-3-1-2-4-12(11)24-13/h1-7H,(H,22,23)
PDB
MMDB

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antibodypedia
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PC cid
PC sid
UniChem

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PubMed
n/an/a 5.50E+3n/an/an/an/an/an/a



Janssen Research& Development

Curated by ChEMBL


Assay Description
Inhibition of human PI3Kgamma using PIP2 as substrate by HTRF assay in presence of biotin-PIP3


J Med Chem 59: 4302-13 (2016)

More data for this
Ligand-Target Pair