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SMILES: Cc1ccc(cc1)-c1c(\C=C(/C#N)c2cc[n+]([O-])cc2)n(CCCO)c2ncnc(N)c12

InChI Key: InChIKey=HLVIJJBGDOMGGW-CPNJWEJPSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 259866   
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
Ribosomal protein S6 kinase alpha-3 [399-740]


(Homo sapiens (Human))		BDBM259866
PNG
(US9505766, 71)
Show SMILES Cc1ccc(cc1)-c1c(\C=C(/C#N)c2cc[n+]([O-])cc2)n(CCCO)c2ncnc(N)c12
Show InChI InChI=1S/C24H22N6O2/c1-16-3-5-18(6-4-16)21-20(13-19(14-25)17-7-10-29(32)11-8-17)30(9-2-12-31)24-22(21)23(26)27-15-28-24/h3-8,10-11,13,15,31H,2,9,12H2,1H3,(H2,26,27,28)/b19-13+
UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
n/an/a>500n/an/an/an/a8.022



THE REGENTS OF THE UNIVERSITY OF CALIFORNIA

US Patent


Assay Description
RSK2 CTD and His6-ERK2 were expressed and purified as described (Cohen et al., Science, 308: 1318). The C436V mutant of RSK2 CTD was generated by Qui...

US Patent US9505766 (2016)


BindingDB Entry DOI: 10.7270/Q2639NPR
More data for this
Ligand-Target Pair