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SMILES: CC(C)Nc1cc(ncc1-c1cnn(CC(C)(C)O)c1)-c1cnc2cc(Cl)cnn12

InChI Key: InChIKey=ZACIZZRZZPYFAZ-UHFFFAOYSA-N

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 347049   
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
G protein-activated inward rectifier potassium channel 4


(Homo sapiens (Human))		BDBM347049
PNG
(US10202390, Example 4)
Show SMILES CC(C)Nc1cc(ncc1-c1cnn(CC(C)(C)O)c1)-c1cnc2cc(Cl)cnn12
Show InChI InChI=1S/C21H24ClN7O/c1-13(2)27-17-6-18(19-10-24-20-5-15(22)8-26-29(19)20)23-9-16(17)14-7-25-28(11-14)12-21(3,4)30/h5-11,13,30H,12H2,1-4H3,(H,23,27)
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US Patent
n/an/a 396n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
TBD

US Patent US10202390 (2019)


BindingDB Entry DOI: 10.7270/Q28W3GDC
More data for this
Ligand-Target Pair