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SMILES: COc1cccc(c1)C#Cc1c[nH]c2ncc(cc12)-c1ccc(OC)c(OC)c1

InChI Key: InChIKey=OUPCKSILKHLXJP-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50502307   
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
AP2-associated protein kinase 1


(Homo sapiens (Human))		BDBM50502307
PNG
(CHEMBL4454007)
Show SMILES COc1cccc(c1)C#Cc1c[nH]c2ncc(cc12)-c1ccc(OC)c(OC)c1
Show InChI InChI=1S/C24H20N2O3/c1-27-20-6-4-5-16(11-20)7-8-18-14-25-24-21(18)12-19(15-26-24)17-9-10-22(28-2)23(13-17)29-3/h4-6,9-15H,1-3H3,(H,25,26)
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 149n/an/an/an/an/an/a



KU Leuven

Curated by ChEMBL


Assay Description
Displacement of tracer 222 from GST-tagged recombinant human AAK1 catalytic domain (1 to 510 amino acids) expressed in insect cells shaken for 30 sec...

J Med Chem 62: 5810-5831 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00136
More data for this
Ligand-Target Pair