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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'AP2-associated protein kinase 1 (AAK1)' and Ligand = 'BDBM335648'   
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
AP2-associated protein kinase 1 (AAK1)


(Homo sapiens (Human))
BDBM335648
PNG
(N-(3-(2-isopropyl-2H-tetrazol-5-yl)phenyl)-5-methy...)
Show SMILES CC(C)n1nnc(n1)-c1cccc(Nc2ncnn3ccc(C)c23)c1
Show InChI InChI=1S/C17H18N8/c1-11(2)25-22-16(21-23-25)13-5-4-6-14(9-13)20-17-15-12(3)7-8-24(15)19-10-18-17/h4-11H,1-3H3,(H,18,19,20)
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 22n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The assays were performed in U-bottom 384-well plates. The final assay volume was 30 μl prepared from 15 μl additions of enzyme and substra...


US Patent US9737542 (2017)

More data for this
Ligand-Target Pair