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BDBM50440467 CHEMBL2425886

SMILES: CC#CCn1c(cc(=O)n(Cc2ccc3ccccc3n2)c1=O)N1CCC[C@@H](N)C1

InChI Key: InChIKey=UQXZWOAEVRHHOF-GOSISDBHSA-N

Data: 2 IC50

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

Found 2 hits for monomerid = 50440467   
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 VIII


(Homo sapiens (Human))
BDBM50440467
PNG
(CHEMBL2425886)
Show SMILES CC#CCn1c(cc(=O)n(Cc2ccc3ccccc3n2)c1=O)N1CCC[C@@H](N)C1 |r|
Show InChI InChI=1S/C23H25N5O2/c1-2-3-13-27-21(26-12-6-8-18(24)15-26)14-22(29)28(23(27)30)16-19-11-10-17-7-4-5-9-20(17)25-19/h4-5,7,9-11,14,18H,6,8,12-13,15-16,24H2,1H3/t18-/m1/s1
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



First Affiliated Hospital of Guangzhou Medical University

Curated by ChEMBL


Assay Description
Inhibition of DPP-8 (unknown origin)


Eur J Med Chem 68: 312-20 (2013)


Article DOI: 10.1016/j.ejmech.2013.08.010
BindingDB Entry DOI: 10.7270/Q23J3FDZ
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 9


(Homo sapiens (Human))
BDBM50440467
PNG
(CHEMBL2425886)
Show SMILES CC#CCn1c(cc(=O)n(Cc2ccc3ccccc3n2)c1=O)N1CCC[C@@H](N)C1 |r|
Show InChI InChI=1S/C23H25N5O2/c1-2-3-13-27-21(26-12-6-8-18(24)15-26)14-22(29)28(23(27)30)16-19-11-10-17-7-4-5-9-20(17)25-19/h4-5,7,9-11,14,18H,6,8,12-13,15-16,24H2,1H3/t18-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



First Affiliated Hospital of Guangzhou Medical University

Curated by ChEMBL


Assay Description
Inhibition of DPP-9 (unknown origin)


Eur J Med Chem 68: 312-20 (2013)


Article DOI: 10.1016/j.ejmech.2013.08.010
BindingDB Entry DOI: 10.7270/Q23J3FDZ
More data for this
Ligand-Target Pair