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SMILES: COc1cccc(C(O)=O)c1Cn1c(=O)n(C)c2nc(N3CCC[C@@H](N)C3)n(CC#CC)c2c1=O

InChI Key: InChIKey=FQDSQWFDYUAIKG-OAHLLOKOSA-N

Find this compound or compounds like it in BindingDB or PDB:
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50516914   
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))
BDBM50516914
PNG
(CHEMBL4458832)
Show SMILES COc1cccc(C(O)=O)c1Cn1c(=O)n(C)c2nc(N3CCC[C@@H](N)C3)n(CC#CC)c2c1=O |r|
Show InChI InChI=1S/C24H28N6O5/c1-4-5-12-29-19-20(26-23(29)28-11-7-8-15(25)13-28)27(2)24(34)30(21(19)31)14-17-16(22(32)33)9-6-10-18(17)35-3/h6,9-10,15H,7-8,11-14,25H2,1-3H3,(H,32,33)/t15-/m1/s1
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 6n/an/an/an/an/an/a



Guangxi Medical University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human DPP4 expressed in baculovirus infected Sf9 insect cells using Gly-Pro-AMC as substrate preincubated for 15 mins follo...


Eur J Med Chem 180: 509-523 (2019)


Article DOI: 10.1016/j.ejmech.2019.07.045
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50516914
PNG
(CHEMBL4458832)
Show SMILES COc1cccc(C(O)=O)c1Cn1c(=O)n(C)c2nc(N3CCC[C@@H](N)C3)n(CC#CC)c2c1=O |r|
Show InChI InChI=1S/C24H28N6O5/c1-4-5-12-29-19-20(26-23(29)28-11-7-8-15(25)13-28)27(2)24(34)30(21(19)31)14-17-16(22(32)33)9-6-10-18(17)35-3/h6,9-10,15H,7-8,11-14,25H2,1-3H3,(H,32,33)/t15-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Guangxi Medical University

Curated by ChEMBL


Assay Description
Inhibition of DPP8 (unknown origin) using Gly-Pro-AMC as substrate preincubated for 15 mins followed by substrate addition measured at 60 secs interv...


Eur J Med Chem 180: 509-523 (2019)


Article DOI: 10.1016/j.ejmech.2019.07.045
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50516914
PNG
(CHEMBL4458832)
Show SMILES COc1cccc(C(O)=O)c1Cn1c(=O)n(C)c2nc(N3CCC[C@@H](N)C3)n(CC#CC)c2c1=O |r|
Show InChI InChI=1S/C24H28N6O5/c1-4-5-12-29-19-20(26-23(29)28-11-7-8-15(25)13-28)27(2)24(34)30(21(19)31)14-17-16(22(32)33)9-6-10-18(17)35-3/h6,9-10,15H,7-8,11-14,25H2,1-3H3,(H,32,33)/t15-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Guangxi Medical University

Curated by ChEMBL


Assay Description
Inhibition of DPP9 (unknown origin) using Gly-Pro-AMC as substrate preincubated for 15 mins followed by substrate addition measured at 60 secs interv...


Eur J Med Chem 180: 509-523 (2019)


Article DOI: 10.1016/j.ejmech.2019.07.045
More data for this
Ligand-Target Pair