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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prolyl endopeptidase FAP' and Ligand = 'BDBM50364168'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Prolyl endopeptidase FAP


(Homo sapiens (Human))
BDBM50364168
PNG
(CHEMBL1951613)
Show SMILES CC#CCn1c(N2CCCNCC2)c(C#N)c2n(C)c(=O)n(Cc3nc(C)c4ccccc4n3)c(=O)c12
Show InChI InChI=1S/C27H28N8O2/c1-4-5-14-34-24-23(20(16-28)25(34)33-13-8-11-29-12-15-33)32(3)27(37)35(26(24)36)17-22-30-18(2)19-9-6-7-10-21(19)31-22/h6-7,9-10,29H,8,11-15,17H2,1-3H3
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MMDB

KEGG

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PC cid
PC sid
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Patents


Similars

Article
PubMed
n/an/a 4.70E+3n/an/an/an/an/an/a



Argenta Discovery Ltd.

Curated by ChEMBL


Assay Description
Inhibition of FAP


Bioorg Med Chem Lett 22: 1464-8 (2012)


Article DOI: 10.1016/j.bmcl.2011.11.054
BindingDB Entry DOI: 10.7270/Q2SF2WN8
More data for this
Ligand-Target Pair