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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Peregrin' and Ligand = 'BDBM50032914'   
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
Peregrin


(Homo sapiens (Human))
BDBM50032914
PNG
(CHEMBL3356142)
Show SMILES Cn1c2cc(NC(=O)Cc3ccccc3)c(cc2n(C)c1=O)N1CCCCC1
Show InChI InChI=1S/C22H26N4O2/c1-24-19-14-17(23-21(27)13-16-9-5-3-6-10-16)18(26-11-7-4-8-12-26)15-20(19)25(2)22(24)28/h3,5-6,9-10,14-15H,4,7-8,11-13H2,1-2H3,(H,23,27)
PDB

KEGG

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 398n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Binding affinity to 6H-Flag-tagged Tev-BRPF1 (622-738 aa) (unknown origin) by TR-FRET competitive assay


ACS Med Chem Lett 5: 1190-5 (2014)


Article DOI: 10.1021/ml5002932
BindingDB Entry DOI: 10.7270/Q2445P29
More data for this
Ligand-Target Pair