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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'fMet-Leu-Phe receptor' and Ligand = 'BDBM454183'   
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
fMet-Leu-Phe receptor


(Homo sapiens (Human))
BDBM454183
PNG
(US10717708, Example 47 | US11186544, Example 47 | ...)
Show SMILES Cc1ccncc1-c1ccc(cc1)N1CCCC(NC(=O)Nc2ccc(cc2)C(F)(F)F)C1=O
Show InChI InChI=1S/C25H23F3N4O2/c1-16-12-13-29-15-21(16)17-4-10-20(11-5-17)32-14-2-3-22(23(32)33)31-24(34)30-19-8-6-18(7-9-19)25(26,27)28/h4-13,15,22H,2-3,14H2,1H3,(H2,30,31,34)
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PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 1.60E+3n/an/an/an/a


TBA

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...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2B56NXP
More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor


(Homo sapiens (Human))
BDBM454183
PNG
(US10717708, Example 47 | US11186544, Example 47 | ...)
Show SMILES Cc1ccncc1-c1ccc(cc1)N1CCCC(NC(=O)Nc2ccc(cc2)C(F)(F)F)C1=O
Show InChI InChI=1S/C25H23F3N4O2/c1-16-12-13-29-15-21(16)17-4-10-20(11-5-17)32-14-2-3-22(23(32)33)31-24(34)30-19-8-6-18(7-9-19)25(26,27)28/h4-13,15,22H,2-3,14H2,1H3,(H2,30,31,34)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 1.60E+3n/an/an/an/a



Bristol-Myers Squibb Company

US Patent


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 (...


US Patent US10717708 (2020)


BindingDB Entry DOI: 10.7270/Q2FB560G
More data for this
Ligand-Target Pair