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BDBM126548 US8778951, 359

SMILES: O[C@H]1CC[C@@H](CC1)Nc1cc(c(Cl)cn1)-c1cccc(NCC2(CCOCC2)C#N)n1

InChI Key: InChIKey=QIBIYLXCABNMFT-QAQDUYKDSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 126548   
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
Cyclin-T1


(Homo sapiens (Human))		BDBM126548
PNG
(US8778951, 359)
Show SMILES O[C@H]1CC[C@@H](CC1)Nc1cc(c(Cl)cn1)-c1cccc(NCC2(CCOCC2)C#N)n1 |r,wU:4.7,wD:1.0,(5.33,1.93,;4,2.7,;4,4.24,;2.67,5,;1.33,4.24,;1.33,2.7,;2.67,1.93,;,5.01,;-1.33,4.23,;-1.33,2.69,;-2.67,1.92,;-4,2.69,;-5.33,1.92,;-4,4.23,;-2.67,5,;-2.67,.38,;-4,-.39,;-4,-1.93,;-2.67,-2.7,;-1.33,-1.93,;,-2.7,;1.33,-1.93,;2.67,-2.7,;2.67,-4.24,;4,-5.01,;5.33,-4.24,;5.33,-2.7,;4,-1.93,;2.67,-1.16,;2.67,.38,;-1.33,-.39,)|
Show InChI InChI=1S/C23H28ClN5O2/c24-19-13-26-22(28-16-4-6-17(30)7-5-16)12-18(19)20-2-1-3-21(29-20)27-15-23(14-25)8-10-31-11-9-23/h1-3,12-13,16-17,30H,4-11,15H2,(H,26,28)(H,27,29)/t16-,17-
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Similars
US Patent
n/an/a 0.000240n/an/an/an/an/an/a



Novartis AG

US Patent


Assay Description
Cdk9/cyclinT1 is purchased from Millipore, cat #14-685. The final total protein concentration in the assay 4 nM. The 5TAMRA-cdk7tide peptide substrat...

US Patent US8778951 (2014)


BindingDB Entry DOI: 10.7270/Q25B014T
More data for this
Ligand-Target Pair