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BDBM50431239 CHEMBL2333029

SMILES: C[C@@H](NC(=O)c1ccncc1F)C(=O)N1CCC[C@H]1B(O)O

InChI Key: InChIKey=ODUXGFPXUMBHHE-KCJUWKMLSA-N

Data: 2 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 2 hits for monomerid = 50431239   
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
Fibroblast activation protein alpha


(Homo sapiens (Human))
BDBM50431239
PNG
(CHEMBL2333029)
Show SMILES C[C@@H](NC(=O)c1ccncc1F)C(=O)N1CCC[C@H]1B(O)O
Show InChI InChI=1S/C13H17BFN3O4/c1-8(13(20)18-6-2-3-11(18)14(21)22)17-12(19)9-4-5-16-7-10(9)15/h4-5,7-8,11,21-22H,2-3,6H2,1H3,(H,17,19)/t8-,11+/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 15n/an/an/an/an/an/a



Tufts University Sackler School of Biomedical Sciences

Curated by ChEMBL


Assay Description
Inhibition of human FAP using Z-Gly-Pro-AMC as substrate preincubated for 10 mins prior to substrate addition by fluorescence assay


J Med Chem 56: 3467-77 (2013)


Article DOI: 10.1021/jm400351a
BindingDB Entry DOI: 10.7270/Q2C53N7W
More data for this
Ligand-Target Pair
Prolyl endopeptidase


(Homo sapiens (Human))
BDBM50431239
PNG
(CHEMBL2333029)
Show SMILES C[C@@H](NC(=O)c1ccncc1F)C(=O)N1CCC[C@H]1B(O)O
Show InChI InChI=1S/C13H17BFN3O4/c1-8(13(20)18-6-2-3-11(18)14(21)22)17-12(19)9-4-5-16-7-10(9)15/h4-5,7-8,11,21-22H,2-3,6H2,1H3,(H,17,19)/t8-,11+/m1/s1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.60E+3n/an/an/an/an/an/a



Tufts University Sackler School of Biomedical Sciences

Curated by ChEMBL


Assay Description
Inhibition of human PREP using Z-Gly-Pro-AMC as substrate preincubated for 10 mins prior to substrate addition by fluorescence assay


J Med Chem 56: 3467-77 (2013)


Article DOI: 10.1021/jm400351a
BindingDB Entry DOI: 10.7270/Q2C53N7W
More data for this
Ligand-Target Pair