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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 = 'BDBM335653'   
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))
BDBM335653
PNG
(3-(5-isopropyl-1,2,4-oxadiazol-3-yl)-5-((5-methylp...)
Show SMILES CC(C)c1nc(no1)-c1cc(O)cc(Nc2ncnn3ccc(C)c23)c1
Show InChI InChI=1S/C18H18N6O2/c1-10(2)18-22-16(23-26-18)12-6-13(8-14(25)7-12)21-17-15-11(3)4-5-24(15)20-9-19-17/h4-10,25H,1-3H3,(H,19,20,21)
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 73n/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