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SMILES: CCCCNc1ncc2c(nn(C3CC[C@H](O)CC3)c2n1)-c1ccc(cc1)S(=O)(=O)N1CCC(N)CC1

InChI Key: InChIKey=YYWGATBDKRRABA-UPDYAAQLSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 336462   
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
Tyrosine-protein kinase Mer


(Homo sapiens (Human))		BDBM336462
PNG
(US9744172, Compound UNC1150A)
Show SMILES CCCCNc1ncc2c(nn(C3CC[C@H](O)CC3)c2n1)-c1ccc(cc1)S(=O)(=O)N1CCC(N)CC1 |r,wD:15.15,(-7.34,-4.52,;-6.01,-3.75,;-4.67,-4.52,;-3.34,-3.75,;-2,-4.52,;-.67,-3.75,;-.67,-2.21,;.66,-1.44,;2,-2.21,;3.46,-1.73,;4.37,-2.98,;3.46,-4.22,;3.86,-5.71,;5.35,-6.11,;5.75,-7.59,;4.66,-8.68,;5.05,-10.17,;3.17,-8.29,;2.77,-6.8,;2,-3.75,;.66,-4.52,;3.86,-.24,;5.35,.16,;5.75,1.64,;4.66,2.73,;3.17,2.33,;2.77,.85,;5.05,4.22,;3.57,4.62,;6.54,3.82,;5.45,5.71,;6.94,6.11,;7.34,7.59,;6.25,8.68,;6.65,10.17,;4.76,8.29,;4.36,6.8,)|
Show InChI InChI=1S/C26H37N7O3S/c1-2-3-14-28-26-29-17-23-24(31-33(25(23)30-26)20-6-8-21(34)9-7-20)18-4-10-22(11-5-18)37(35,36)32-15-12-19(27)13-16-32/h4-5,10-11,17,19-21,34H,2-3,6-9,12-16,27H2,1H3,(H,28,29,30)/t20?,21-
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US Patent
n/an/a<10n/an/an/an/an/an/a



The University of North Carolina at Chapel Hill

US Patent


Assay Description
The ectopic expression of Mer receptor tyrosine kinase (Mer) has been identified as a tumor cell survival gene product in Acute Lymphoblastic Leukemi...

US Patent US9744172 (2017)


BindingDB Entry DOI: 10.7270/Q2PR7Z30
More data for this
Ligand-Target Pair