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SMILES: CC(C)n1nc(C#Cc2cc(NC(=O)c3ccc(CN4CCN(C)CC4)cc3)ccc2C)c2c(N)ncnc12

InChI Key: InChIKey=TVJIDCCWASCDEI-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 378889   
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
Proto-oncogene tyrosine-protein kinase Src [1-530]


(Homo sapiens (Human))		BDBM378889
PNG
(Preparation of N-(3-((4-amino-1-isopropyl-1H-pyraz...)
Show SMILES CC(C)n1nc(C#Cc2cc(NC(=O)c3ccc(CN4CCN(C)CC4)cc3)ccc2C)c2c(N)ncnc12
Show InChI InChI=1S/C30H34N8O/c1-20(2)38-29-27(28(31)32-19-33-29)26(35-38)12-10-24-17-25(11-5-21(24)3)34-30(39)23-8-6-22(7-9-23)18-37-15-13-36(4)14-16-37/h5-9,11,17,19-20H,13-16,18H2,1-4H3,(H,34,39)(H2,31,32,33)
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
n/an/a 4n/an/an/an/an/an/a



Kalypsys, Inc.



Assay Description
The aim of this experiment is to detect the inhibitory activity of the compounds of the present invention against in vitro protein kinases using isot...

Bioorg Med Chem Lett 17: 3562-9 (2007)


BindingDB Entry DOI: 10.7270/Q21C2065
More data for this
Ligand-Target Pair