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SMILES: CO[C@@H]1CO[C@@H](CC[C@H]1N)c1c(NC(=O)c2csc(n2)-c2ncccc2C)cnn1C

InChI Key: InChIKey=NCLVNWAXZPPDBJ-XOKHGSTOSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 227396   
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 pim-1


(Homo sapiens (Human))		BDBM227396
PNG
(US9328106, 348)
Show SMILES CO[C@@H]1CO[C@@H](CC[C@H]1N)c1c(NC(=O)c2csc(n2)-c2ncccc2C)cnn1C |r|
Show InChI InChI=1S/C21H26N6O3S/c1-12-5-4-8-23-18(12)21-26-15(11-31-21)20(28)25-14-9-24-27(2)19(14)16-7-6-13(22)17(29-3)10-30-16/h4-5,8-9,11,13,16-17H,6-7,10,22H2,1-3H3,(H,25,28)/t13-,16+,17-/m1/s1
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KEGG

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PC cid
PC sid
UniChem
US Patent
 0.0140 -14.8n/an/an/an/an/a7.225



GENENTECH, INC.

US Patent


Assay Description
LC3K assay: PIM-1, -2, and -3 enzymes were generated as fusion proteins expressed in bacteria and purified by IMAC column chromatography (Sun, X., Ch...

US Patent US9328106 (2016)


BindingDB Entry DOI: 10.7270/Q29W0DBT
More data for this
Ligand-Target Pair