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BDBM50249100 CHEMBL473188::cis-(3-fluoroazetidin-1-yl)((2S,4S)-4-(4-(pyrimidin-2-yl)piperazin-1-yl)pyrrolidin-2-yl)methanone

SMILES: FC1CN(C1)C(=O)[C@@H]1C[C@@H](CN1)N1CCN(CC1)c1ncccn1

InChI Key: InChIKey=SQYBOLCVZXHFPW-KBPBESRZSA-N

Data: 3 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50249100   
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))
BDBM50249100
PNG
(CHEMBL473188 | cis-(3-fluoroazetidin-1-yl)((2S,4S)...)
Show SMILES FC1CN(C1)C(=O)[C@@H]1C[C@@H](CN1)N1CCN(CC1)c1ncccn1 |r|
Show InChI InChI=1S/C16H23FN6O/c17-12-10-23(11-12)15(24)14-8-13(9-20-14)21-4-6-22(7-5-21)16-18-2-1-3-19-16/h1-3,12-14,20H,4-11H2/t13-,14-/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 41n/an/an/an/an/an/a



Pfizer Global Research & Development

Curated by ChEMBL


Assay Description
Inhibition of human plasma DPP4


Bioorg Med Chem Lett 19: 1991-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.041
BindingDB Entry DOI: 10.7270/Q2FB52S4
More data for this
Ligand-Target Pair
Dipeptidyl peptidase VIII


(Homo sapiens (Human))
BDBM50249100
PNG
(CHEMBL473188 | cis-(3-fluoroazetidin-1-yl)((2S,4S)...)
Show SMILES FC1CN(C1)C(=O)[C@@H]1C[C@@H](CN1)N1CCN(CC1)c1ncccn1 |r|
Show InChI InChI=1S/C16H23FN6O/c17-12-10-23(11-12)15(24)14-8-13(9-20-14)21-4-6-22(7-5-21)16-18-2-1-3-19-16/h1-3,12-14,20H,4-11H2/t13-,14-/m0/s1
PDB

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UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>3.00E+4n/an/an/an/an/an/a



Pfizer Global Research & Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP8


Bioorg Med Chem Lett 19: 1991-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.041
BindingDB Entry DOI: 10.7270/Q2FB52S4
More data for this
Ligand-Target Pair
Dipeptidyl peptidase 2 (DPP II)


(Homo sapiens (Human))
BDBM50249100
PNG
(CHEMBL473188 | cis-(3-fluoroazetidin-1-yl)((2S,4S)...)
Show SMILES FC1CN(C1)C(=O)[C@@H]1C[C@@H](CN1)N1CCN(CC1)c1ncccn1 |r|
Show InChI InChI=1S/C16H23FN6O/c17-12-10-23(11-12)15(24)14-8-13(9-20-14)21-4-6-22(7-5-21)16-18-2-1-3-19-16/h1-3,12-14,20H,4-11H2/t13-,14-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>3.00E+4n/an/an/an/an/an/a



Pfizer Global Research & Development

Curated by ChEMBL


Assay Description
Inhibition of human recombinant DPP2


Bioorg Med Chem Lett 19: 1991-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.041
BindingDB Entry DOI: 10.7270/Q2FB52S4
More data for this
Ligand-Target Pair