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SMILES: COc1cc(ccc1Nc1nc(Cc2c(Cl)cccc2Cl)c2nc[nH]c2c1C(N)=O)C(=O)N1CCN(C)CC1

InChI Key: InChIKey=UNCSVCLCFJSEPG-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 196874   
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
ALK tyrosine kinase receptor


(Homo sapiens (Human))		BDBM196874
PNG
(US9212192, 37)
Show SMILES COc1cc(ccc1Nc1nc(Cc2c(Cl)cccc2Cl)c2nc[nH]c2c1C(N)=O)C(=O)N1CCN(C)CC1
Show InChI InChI=1S/C27H27Cl2N7O3/c1-35-8-10-36(11-9-35)27(38)15-6-7-19(21(12-15)39-2)33-26-22(25(30)37)24-23(31-14-32-24)20(34-26)13-16-17(28)4-3-5-18(16)29/h3-7,12,14H,8-11,13H2,1-2H3,(H2,30,37)(H,31,32)(H,33,34)
PDB

KEGG

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antibodypedia
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PC cid
PC sid
UniChem
US Patent
 4 -11.4n/an/an/an/an/a7.425



AbbVie Inc.

US Patent


Assay Description
ALK kinase assays were conducted with the indicated final concentrations unless otherwise specified. In 384 well black plates (Axygen), 8 ul of compo...

US Patent US9212192 (2015)


BindingDB Entry DOI: 10.7270/Q2D79971
More data for this
Ligand-Target Pair