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SMILES: CC#CCn1c(cc(=O)n(Cc2ccc(Br)c(c2)C(O)=O)c1=O)N1CCC[C@@H](N)C1

InChI Key:

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 = 50577961   
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 9


(Homo sapiens (Human))
BDBM50577961
PNG
(CHEMBL4856337)
Show SMILES CC#CCn1c(cc(=O)n(Cc2ccc(Br)c(c2)C(O)=O)c1=O)N1CCC[C@@H](N)C1 |r|
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>100n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human recombinant DPP9 using Gly-Pro-AMC as substrate preincubated for 15 mins followed by substrate addition and measured for 20 mins ...


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113765
BindingDB Entry DOI: 10.7270/Q2J67MS2
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 4


(Homo sapiens (Human))
BDBM50577961
PNG
(CHEMBL4856337)
Show SMILES CC#CCn1c(cc(=O)n(Cc2ccc(Br)c(c2)C(O)=O)c1=O)N1CCC[C@@H](N)C1 |r|
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 0.800n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human recombinant DPP4 using Gly-Pro-AMC as substrate preincubated for 15 mins followed by substrate addition and measured for 20 mins ...


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113765
BindingDB Entry DOI: 10.7270/Q2J67MS2
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 8


(Homo sapiens (Human))
BDBM50577961
PNG
(CHEMBL4856337)
Show SMILES CC#CCn1c(cc(=O)n(Cc2ccc(Br)c(c2)C(O)=O)c1=O)N1CCC[C@@H](N)C1 |r|
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>100n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human recombinant DPP8 using Gly-Pro-AMC as substrate preincubated for 15 mins followed by substrate addition and measured for 20 mins ...


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113765
BindingDB Entry DOI: 10.7270/Q2J67MS2
More data for this
Ligand-Target Pair