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Compile Data Set for Download or QSAR

Found 6 hits Enz. Inhib. hit(s) with Target = 'N-formyl peptide receptor 2' and Ligand = 'BDBM50520823'   
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
N-formyl peptide receptor 2


(Homo sapiens (Human))
BDBM50520823
PNG
(CHEMBL4434857)
Show SMILES CCCCC[C@H](O)c1nc(oc1\C=C\[C@@H](O)[C@@H](O)CCCC(=O)OC(C)C)-c1ccccc1 |r|
Show InChI InChI=1S/C26H37NO6/c1-4-5-7-13-22(30)25-23(33-26(27-25)19-11-8-6-9-12-19)17-16-21(29)20(28)14-10-15-24(31)32-18(2)3/h6,8-9,11-12,16-18,20-22,28-30H,4-5,7,10,13-15H2,1-3H3/b17-16+/t20-,21+,22-/m0/s1
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n/an/a 2.5n/an/an/an/an/an/a



University College Dublin

Curated by ChEMBL


Assay Description
Agonist activity at ALX/FPR2 in human THP1 cells harboring NF-kB-Luc assessed as inhibition of LPS-induced NFkB signalling activation by measuring re...


Eur J Med Chem 162: 80-108 (2019)


Article DOI: 10.1016/j.ejmech.2018.10.049
BindingDB Entry DOI: 10.7270/Q2PV6PS9
More data for this
Ligand-Target Pair
N-formyl peptide receptor 2


(Homo sapiens (Human))
BDBM50520823
PNG
(CHEMBL4434857)
Show SMILES CCCCC[C@H](O)c1nc(oc1\C=C\[C@@H](O)[C@@H](O)CCCC(=O)OC(C)C)-c1ccccc1 |r|
Show InChI InChI=1S/C26H37NO6/c1-4-5-7-13-22(30)25-23(33-26(27-25)19-11-8-6-9-12-19)17-16-21(29)20(28)14-10-15-24(31)32-18(2)3/h6,8-9,11-12,16-18,20-22,28-30H,4-5,7,10,13-15H2,1-3H3/b17-16+/t20-,21+,22-/m0/s1
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n/an/a 3.20n/an/an/an/an/an/a



University College Dublin

Curated by ChEMBL


Assay Description
Agonist activity at ALX/FPR2 in human THP1 cells harboring NF-kB-Luc assessed as inhibition of LPS-induced NFkB signalling activation by measuring re...


Eur J Med Chem 162: 80-108 (2019)


Article DOI: 10.1016/j.ejmech.2018.10.049
BindingDB Entry DOI: 10.7270/Q2PV6PS9
More data for this
Ligand-Target Pair
N-formyl peptide receptor 2


(Homo sapiens (Human))
BDBM50520823
PNG
(CHEMBL4434857)
Show SMILES CCCCC[C@H](O)c1nc(oc1\C=C\[C@@H](O)[C@@H](O)CCCC(=O)OC(C)C)-c1ccccc1 |r|
Show InChI InChI=1S/C26H37NO6/c1-4-5-7-13-22(30)25-23(33-26(27-25)19-11-8-6-9-12-19)17-16-21(29)20(28)14-10-15-24(31)32-18(2)3/h6,8-9,11-12,16-18,20-22,28-30H,4-5,7,10,13-15H2,1-3H3/b17-16+/t20-,21+,22-/m0/s1
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n/an/a 5.10n/an/an/an/an/an/a



University College Dublin

Curated by ChEMBL


Assay Description
Agonist activity at ALX/FPR2 in human THP1 cells harboring NF-kB-Luc assessed as inhibition of LPS-induced NFkB signalling activation by measuring re...


Eur J Med Chem 162: 80-108 (2019)


Article DOI: 10.1016/j.ejmech.2018.10.049
BindingDB Entry DOI: 10.7270/Q2PV6PS9
More data for this
Ligand-Target Pair
N-formyl peptide receptor 2


(Homo sapiens (Human))
BDBM50520823
PNG
(CHEMBL4434857)
Show SMILES CCCCC[C@H](O)c1nc(oc1\C=C\[C@@H](O)[C@@H](O)CCCC(=O)OC(C)C)-c1ccccc1 |r|
Show InChI InChI=1S/C26H37NO6/c1-4-5-7-13-22(30)25-23(33-26(27-25)19-11-8-6-9-12-19)17-16-21(29)20(28)14-10-15-24(31)32-18(2)3/h6,8-9,11-12,16-18,20-22,28-30H,4-5,7,10,13-15H2,1-3H3/b17-16+/t20-,21+,22-/m0/s1
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n/an/a 6.70n/an/an/an/an/an/a



University College Dublin

Curated by ChEMBL


Assay Description
Agonist activity at ALX/FPR2 in human THP1 cells harboring NF-kB-Luc assessed as inhibition of LPS-induced NFkB signalling activation by measuring re...


Eur J Med Chem 162: 80-108 (2019)


Article DOI: 10.1016/j.ejmech.2018.10.049
BindingDB Entry DOI: 10.7270/Q2PV6PS9
More data for this
Ligand-Target Pair
N-formyl peptide receptor 2


(Homo sapiens (Human))
BDBM50520823
PNG
(CHEMBL4434857)
Show SMILES CCCCC[C@H](O)c1nc(oc1\C=C\[C@@H](O)[C@@H](O)CCCC(=O)OC(C)C)-c1ccccc1 |r|
Show InChI InChI=1S/C26H37NO6/c1-4-5-7-13-22(30)25-23(33-26(27-25)19-11-8-6-9-12-19)17-16-21(29)20(28)14-10-15-24(31)32-18(2)3/h6,8-9,11-12,16-18,20-22,28-30H,4-5,7,10,13-15H2,1-3H3/b17-16+/t20-,21+,22-/m0/s1
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n/an/a 31n/an/an/an/an/an/a



University College Dublin

Curated by ChEMBL


Assay Description
Agonist activity at ALX/FPR2 in human THP1 cells harboring NF-kB-Luc assessed as inhibition of LPS-induced NFkB signalling activation by measuring re...


Eur J Med Chem 162: 80-108 (2019)


Article DOI: 10.1016/j.ejmech.2018.10.049
BindingDB Entry DOI: 10.7270/Q2PV6PS9
More data for this
Ligand-Target Pair
N-formyl peptide receptor 2


(Homo sapiens (Human))
BDBM50520823
PNG
(CHEMBL4434857)
Show SMILES CCCCC[C@H](O)c1nc(oc1\C=C\[C@@H](O)[C@@H](O)CCCC(=O)OC(C)C)-c1ccccc1 |r|
Show InChI InChI=1S/C26H37NO6/c1-4-5-7-13-22(30)25-23(33-26(27-25)19-11-8-6-9-12-19)17-16-21(29)20(28)14-10-15-24(31)32-18(2)3/h6,8-9,11-12,16-18,20-22,28-30H,4-5,7,10,13-15H2,1-3H3/b17-16+/t20-,21+,22-/m0/s1
PDB

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PC cid
PC sid
UniChem
Article
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n/an/a 70n/an/an/an/an/an/a



University College Dublin

Curated by ChEMBL


Assay Description
Agonist activity at ALX/FPR2 in human THP1 cells harboring NF-kB-Luc assessed as inhibition of LPS-induced NFkB signalling activation pretreated for ...


Eur J Med Chem 162: 80-108 (2019)


Article DOI: 10.1016/j.ejmech.2018.10.049
BindingDB Entry DOI: 10.7270/Q2PV6PS9
More data for this
Ligand-Target Pair