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BDBM50359367 CHEMBL1929388

SMILES: Cc1cc2ncc(C(=O)NCC(C)(C)NCC(=O)N3CCC[C@H]3C#N)c(C)n2n1

InChI Key: InChIKey=WFOKSQKLWVYFPZ-HNNXBMFYSA-N

Data: 3 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 3 hits for monomerid = 50359367   
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))
BDBM50359367
PNG
(CHEMBL1929388)
Show SMILES Cc1cc2ncc(C(=O)NCC(C)(C)NCC(=O)N3CCC[C@H]3C#N)c(C)n2n1 |r|
Show InChI InChI=1S/C20H27N7O2/c1-13-8-17-22-10-16(14(2)27(17)25-13)19(29)23-12-20(3,4)24-11-18(28)26-7-5-6-15(26)9-21/h8,10,15,24H,5-7,11-12H2,1-4H3,(H,23,29)/t15-/m0/s1
PDB
MMDB

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KEGG

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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 13n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP-4 using H-Gly-Pro-AMC as substrate preincubated for 30 mins before substrate addition measured after 20 mins by f...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50359367
PNG
(CHEMBL1929388)
Show SMILES Cc1cc2ncc(C(=O)NCC(C)(C)NCC(=O)N3CCC[C@H]3C#N)c(C)n2n1 |r|
Show InChI InChI=1S/C20H27N7O2/c1-13-8-17-22-10-16(14(2)27(17)25-13)19(29)23-12-20(3,4)24-11-18(28)26-7-5-6-15(26)9-21/h8,10,15,24H,5-7,11-12H2,1-4H3,(H,23,29)/t15-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 64n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP-9 expressed in Sf9 cells using H-Gly-Pro-AMC as substrate preincubated for 30 mins before substrate addition meas...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50359367
PNG
(CHEMBL1929388)
Show SMILES Cc1cc2ncc(C(=O)NCC(C)(C)NCC(=O)N3CCC[C@H]3C#N)c(C)n2n1 |r|
Show InChI InChI=1S/C20H27N7O2/c1-13-8-17-22-10-16(14(2)27(17)25-13)19(29)23-12-20(3,4)24-11-18(28)26-7-5-6-15(26)9-21/h8,10,15,24H,5-7,11-12H2,1-4H3,(H,23,29)/t15-/m0/s1
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 76n/an/an/an/an/an/a



Sanwa Kagaku Kenkyusho Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP-8 expressed in Sf9 cells using H-Gly-Pro-AMC as substrate preincubated for 30 mins before substrate addition meas...


Bioorg Med Chem 19: 7221-7 (2011)


Article DOI: 10.1016/j.bmc.2011.09.043
BindingDB Entry DOI: 10.7270/Q2862GVX
More data for this
Ligand-Target Pair