BindingDB logo
myBDB logout

null

SMILES: OCc1ccccc1-c1ccc(cc1)N1CCC[C@@H](NC(=O)Nc2ccc(Cl)cc2)C1=O

InChI Key: InChIKey=VGJIQXOSXZUOKM-HSZRJFAPSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 454189   
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
N-formyl peptide receptor 2


(Homo sapiens (Human))
BDBM454189
PNG
(US10717708, Example 77 | US11186544, Example 77)
Show SMILES OCc1ccccc1-c1ccc(cc1)N1CCC[C@@H](NC(=O)Nc2ccc(Cl)cc2)C1=O |r|
Show InChI InChI=1S/C25H24ClN3O3/c26-19-9-11-20(12-10-19)27-25(32)28-23-6-3-15-29(24(23)31)21-13-7-17(8-14-21)22-5-2-1-4-18(22)16-30/h1-2,4-5,7-14,23,30H,3,6,15-16H2,(H2,27,28,32)/t23-/m1/s1
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 0.680n/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)

More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor


(Homo sapiens (Human))
BDBM454189
PNG
(US10717708, Example 77 | US11186544, Example 77)
Show SMILES OCc1ccccc1-c1ccc(cc1)N1CCC[C@@H](NC(=O)Nc2ccc(Cl)cc2)C1=O |r|
Show InChI InChI=1S/C25H24ClN3O3/c26-19-9-11-20(12-10-19)27-25(32)28-23-6-3-15-29(24(23)31)21-13-7-17(8-14-21)22-5-2-1-4-18(22)16-30/h1-2,4-5,7-14,23,30H,3,6,15-16H2,(H2,27,28,32)/t23-/m1/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/an/an/a 8.80n/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
N-formyl peptide receptor 2


(Homo sapiens (Human))
BDBM454189
PNG
(US10717708, Example 77 | US11186544, Example 77)
Show SMILES OCc1ccccc1-c1ccc(cc1)N1CCC[C@@H](NC(=O)Nc2ccc(Cl)cc2)C1=O |r|
Show InChI InChI=1S/C25H24ClN3O3/c26-19-9-11-20(12-10-19)27-25(32)28-23-6-3-15-29(24(23)31)21-13-7-17(8-14-21)22-5-2-1-4-18(22)16-30/h1-2,4-5,7-14,23,30H,3,6,15-16H2,(H2,27,28,32)/t23-/m1/s1
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/an/an/a 0.680n/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor


(Homo sapiens (Human))
BDBM454189
PNG
(US10717708, Example 77 | US11186544, Example 77)
Show SMILES OCc1ccccc1-c1ccc(cc1)N1CCC[C@@H](NC(=O)Nc2ccc(Cl)cc2)C1=O |r|
Show InChI InChI=1S/C25H24ClN3O3/c26-19-9-11-20(12-10-19)27-25(32)28-23-6-3-15-29(24(23)31)21-13-7-17(8-14-21)22-5-2-1-4-18(22)16-30/h1-2,4-5,7-14,23,30H,3,6,15-16H2,(H2,27,28,32)/t23-/m1/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 8.80n/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)

More data for this
Ligand-Target Pair