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BDBM50135054 CHEMBL344507::Compound 9.35::[(2-Cyclopentylamino-acetylamino)-phenyl-methyl]-phosphonic acid diphenyl ester

SMILES: O=C(CNC1CCCC1)NC(c1ccccc1)P(=O)(Oc1ccccc1)Oc1ccccc1

InChI Key: InChIKey=KMXSJSIRHCXWKV-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50135054   
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))
BDBM50135054
PNG
(CHEMBL344507 | Compound 9.35 | [(2-Cyclopentylamin...)
Show SMILES O=C(CNC1CCCC1)NC(c1ccccc1)P(=O)(Oc1ccccc1)Oc1ccccc1
Show InChI InChI=1S/C26H29N2O4P/c29-25(20-27-22-14-10-11-15-22)28-26(21-12-4-1-5-13-21)33(30,31-23-16-6-2-7-17-23)32-24-18-8-3-9-19-24/h1-9,12-13,16-19,22,26-27H,10-11,14-15,20H2,(H,28,29)
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Article
PubMed
n/an/a>1.25E+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 4


(Homo sapiens (Human))
BDBM50135054
PNG
(CHEMBL344507 | Compound 9.35 | [(2-Cyclopentylamin...)
Show SMILES O=C(CNC1CCCC1)NC(c1ccccc1)P(=O)(Oc1ccccc1)Oc1ccccc1
Show InChI InChI=1S/C26H29N2O4P/c29-25(20-27-22-14-10-11-15-22)28-26(21-12-4-1-5-13-21)33(30,31-23-16-6-2-7-17-23)32-24-18-8-3-9-19-24/h1-9,12-13,16-19,22,26-27H,10-11,14-15,20H2,(H,28,29)
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Article
PubMed
n/an/a>1.25E+5n/an/an/an/an/an/a



University of Antwerp (UIA)

Curated by ChEMBL


Assay Description
Inhibitory activity against Dipeptidylpeptidase IV (DPP IV)


J Med Chem 46: 5005-14 (2003)


Article DOI: 10.1021/jm0308803
BindingDB Entry DOI: 10.7270/Q2W37X2F
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50135054
PNG
(CHEMBL344507 | Compound 9.35 | [(2-Cyclopentylamin...)
Show SMILES O=C(CNC1CCCC1)NC(c1ccccc1)P(=O)(Oc1ccccc1)Oc1ccccc1
Show InChI InChI=1S/C26H29N2O4P/c29-25(20-27-22-14-10-11-15-22)28-26(21-12-4-1-5-13-21)33(30,31-23-16-6-2-7-17-23)32-24-18-8-3-9-19-24/h1-9,12-13,16-19,22,26-27H,10-11,14-15,20H2,(H,28,29)
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Article
PubMed
n/an/a 3.80E+3n/an/an/an/an/an/a



University of Antwerp (UIA)

Curated by ChEMBL


Assay Description
Inhibitory activity of compound against Dipeptidylpeptidase II (DPP II)


J Med Chem 46: 5005-14 (2003)


Article DOI: 10.1021/jm0308803
BindingDB Entry DOI: 10.7270/Q2W37X2F
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50135054
PNG
(CHEMBL344507 | Compound 9.35 | [(2-Cyclopentylamin...)
Show SMILES O=C(CNC1CCCC1)NC(c1ccccc1)P(=O)(Oc1ccccc1)Oc1ccccc1
Show InChI InChI=1S/C26H29N2O4P/c29-25(20-27-22-14-10-11-15-22)28-26(21-12-4-1-5-13-21)33(30,31-23-16-6-2-7-17-23)32-24-18-8-3-9-19-24/h1-9,12-13,16-19,22,26-27H,10-11,14-15,20H2,(H,28,29)
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KEGG

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Article
PubMed
n/an/a 3.80E+3n/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