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SMILES: CC(C)Nc1cc(ncn1)-c1ccc2nc(Nc3cc(CN4CCN(CC4)C(=O)C4CC4)ccn3)[nH]c2c1

InChI Key: InChIKey=UVTRBCLHAUFAMV-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 478811   
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
Serine/threonine-protein kinase TBK1


(Homo sapiens (Human))		BDBM478811
PNG
(US10894784, Example 154.03)
Show SMILES CC(C)Nc1cc(ncn1)-c1ccc2nc(Nc3cc(CN4CCN(CC4)C(=O)C4CC4)ccn3)[nH]c2c1
Show InChI InChI=1S/C28H33N9O/c1-18(2)32-26-15-23(30-17-31-26)21-5-6-22-24(14-21)34-28(33-22)35-25-13-19(7-8-29-25)16-36-9-11-37(12-10-36)27(38)20-3-4-20/h5-8,13-15,17-18,20H,3-4,9-12,16H2,1-2H3,(H,30,31,32)(H2,29,33,34,35)
PDB

KEGG

UniProtKB/SwissProt

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antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
US Patent
n/an/a 1.40n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
Recombinant full-length N-terminally His-tagged human TBK1, expressed in insect cells and purified by Ni-NTA affinity chromatography, was purchased f...

US Patent US10894784 (2021)


BindingDB Entry DOI: 10.7270/Q2PV6PFT
More data for this
Ligand-Target Pair