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BDBM98047 (2S)-2-amino-1-(2-diphenoxyphosphorylpyrrolidin-1-yl)-3-phenyl-propan-1-one::CHEMBL237658::Compound 10.7

SMILES: N[C@@H](Cc1ccccc1)C(=O)N1CCCC1P(=O)(Oc1ccccc1)Oc1ccccc1

InChI Key: InChIKey=PLIQWXNVJOPJOT-UXMRNZNESA-N

Data: 5 IC50

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 5 hits for monomerid = 98047   
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
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM98047
PNG
((2S)-2-amino-1-(2-diphenoxyphosphorylpyrrolidin-1-...)
Show SMILES N[C@@H](Cc1ccccc1)C(=O)N1CCCC1P(=O)(Oc1ccccc1)Oc1ccccc1
Show InChI InChI=1S/C25H27N2O4P/c26-23(19-20-11-4-1-5-12-20)25(28)27-18-10-17-24(27)32(29,30-21-13-6-2-7-14-21)31-22-15-8-3-9-16-22/h1-9,11-16,23-24H,10,17-19,26H2/t23-,24?/m0/s1
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Article
PubMed
n/an/a 1.42E+5n/an/an/an/a8.30



University of Anterwerp



Assay Description
Inhibitory concentration of the compound against Dipeptidyl peptidase IV (DPP IV) in Homo sapiens (human)is measured


J Comb Chem 5: 336-44 (2003)


Article DOI: 10.1021/cc020096o
BindingDB Entry DOI: 10.7270/Q2PV6J1S
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM98047
PNG
((2S)-2-amino-1-(2-diphenoxyphosphorylpyrrolidin-1-...)
Show SMILES N[C@@H](Cc1ccccc1)C(=O)N1CCCC1P(=O)(Oc1ccccc1)Oc1ccccc1
Show InChI InChI=1S/C25H27N2O4P/c26-23(19-20-11-4-1-5-12-20)25(28)27-18-10-17-24(27)32(29,30-21-13-6-2-7-14-21)31-22-15-8-3-9-16-22/h1-9,11-16,23-24H,10,17-19,26H2/t23-,24?/m0/s1
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PubMed
n/an/a>1.00E+6n/an/an/an/a5.50



University of Anterwerp



Assay Description
Inhibitory concentration of the compound against Dipeptidyl peptidase IV (DPP IV) in Homo sapiens (human)is measured


J Comb Chem 5: 336-44 (2003)


Article DOI: 10.1021/cc020096o
BindingDB Entry DOI: 10.7270/Q2PV6J1S
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM98047
PNG
((2S)-2-amino-1-(2-diphenoxyphosphorylpyrrolidin-1-...)
Show SMILES N[C@@H](Cc1ccccc1)C(=O)N1CCCC1P(=O)(Oc1ccccc1)Oc1ccccc1
Show InChI InChI=1S/C25H27N2O4P/c26-23(19-20-11-4-1-5-12-20)25(28)27-18-10-17-24(27)32(29,30-21-13-6-2-7-14-21)31-22-15-8-3-9-16-22/h1-9,11-16,23-24H,10,17-19,26H2/t23-,24?/m0/s1
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PubMed
n/an/a>1.00E+6n/an/an/an/an/an/a



University of Antwerp

Curated by ChEMBL


Assay Description
Inhibition of human DPP2


J Med Chem 50: 5568-70 (2007)


Article DOI: 10.1021/jm701005a
BindingDB Entry DOI: 10.7270/Q2S75G2R
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM98047
PNG
((2S)-2-amino-1-(2-diphenoxyphosphorylpyrrolidin-1-...)
Show SMILES N[C@@H](Cc1ccccc1)C(=O)N1CCCC1P(=O)(Oc1ccccc1)Oc1ccccc1
Show InChI InChI=1S/C25H27N2O4P/c26-23(19-20-11-4-1-5-12-20)25(28)27-18-10-17-24(27)32(29,30-21-13-6-2-7-14-21)31-22-15-8-3-9-16-22/h1-9,11-16,23-24H,10,17-19,26H2/t23-,24?/m0/s1
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n/an/a>1.00E+6n/an/an/an/an/an/a



University of Antwerp

Curated by ChEMBL


Assay Description
Inhibition of human DPP8


J Med Chem 50: 5568-70 (2007)


Article DOI: 10.1021/jm701005a
BindingDB Entry DOI: 10.7270/Q2S75G2R
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM98047
PNG
((2S)-2-amino-1-(2-diphenoxyphosphorylpyrrolidin-1-...)
Show SMILES N[C@@H](Cc1ccccc1)C(=O)N1CCCC1P(=O)(Oc1ccccc1)Oc1ccccc1
Show InChI InChI=1S/C25H27N2O4P/c26-23(19-20-11-4-1-5-12-20)25(28)27-18-10-17-24(27)32(29,30-21-13-6-2-7-14-21)31-22-15-8-3-9-16-22/h1-9,11-16,23-24H,10,17-19,26H2/t23-,24?/m0/s1
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Article
PubMed
n/an/a 1.42E+5n/an/an/an/an/an/a



University of Antwerp

Curated by ChEMBL


Assay Description
Inhibition of human DPP4


J Med Chem 50: 5568-70 (2007)


Article DOI: 10.1021/jm701005a
BindingDB Entry DOI: 10.7270/Q2S75G2R
More data for this
Ligand-Target Pair