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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'N-formyl peptide receptor 2' and Ligand = 'BDBM450241'   
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))
BDBM450241
PNG
(US10676431, Example 6 | US11117861, Example 6)
Show SMILES CS(=O)(=O)Nc1ccccc1-c1ccc(N2CC[C@@H](NC(=O)Nc3ccc(cc3)C(F)(F)F)C2=O)c(F)c1F |r|
Show InChI InChI=1S/C25H21F5N4O4S/c1-39(37,38)33-18-5-3-2-4-16(18)17-10-11-20(22(27)21(17)26)34-13-12-19(23(34)35)32-24(36)31-15-8-6-14(7-9-15)25(28,29)30/h2-11,19,33H,12-13H2,1H3,(H2,31,32,36)/t19-/m1/s1
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n/an/an/an/a 1n/an/an/an/a


TBA

Assay Description
FPR2 and FPR1 Cyclic Adenosine Monophosphate (cAMP) Assays. A mixture of forskolin (5 μM final for FPR2 or 10 μM final for FPR1) and IBMX (...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2ZK5KV9
More data for this
Ligand-Target Pair
N-formyl peptide receptor 2


(Homo sapiens (Human))
BDBM450241
PNG
(US10676431, Example 6 | US11117861, Example 6)
Show SMILES CS(=O)(=O)Nc1ccccc1-c1ccc(N2CC[C@@H](NC(=O)Nc3ccc(cc3)C(F)(F)F)C2=O)c(F)c1F |r|
Show InChI InChI=1S/C25H21F5N4O4S/c1-39(37,38)33-18-5-3-2-4-16(18)17-10-11-20(22(27)21(17)26)34-13-12-19(23(34)35)32-24(36)31-15-8-6-14(7-9-15)25(28,29)30/h2-11,19,33H,12-13H2,1H3,(H2,31,32,36)/t19-/m1/s1
PDB

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KEGG

UniProtKB/SwissProt

antibodypedia
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PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 1n/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
A mixture of forskolin (5 μM final for FPR2 or 10 μM final for FPR1) and IBMX (200 μM final) were added to 384-well Proxiplates (Perki...


US Patent US10676431 (2020)


BindingDB Entry DOI: 10.7270/Q2N58QFS
More data for this
Ligand-Target Pair