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SMILES: COc1cc2nc(NCCCCNC(=O)[C@@H](O)C(C)C)c3nnc(C)n3c2cc1C(F)(F)F

InChI Key: InChIKey=DHPACALBVYAURX-KRWDZBQOSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 502557   
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
Bromodomain-containing protein 4


(Homo sapiens (Human))		BDBM502557
PNG
(2-(S)- hydroxy-N- [4-(7- methoxy-1- methyl-8- trif...)
Show SMILES COc1cc2nc(NCCCCNC(=O)[C@@H](O)C(C)C)c3nnc(C)n3c2cc1C(F)(F)F |r|
Show InChI InChI=1S/C21H27F3N6O3/c1-11(2)17(31)20(32)26-8-6-5-7-25-18-19-29-28-12(3)30(19)15-9-13(21(22,23)24)16(33-4)10-14(15)27-18/h9-11,17,31H,5-8H2,1-4H3,(H,25,27)(H,26,32)/t17-/m0/s1
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PC cid
PC sid
UniChem
US Patent
n/an/a 5n/an/an/an/an/an/a



Dong Wha Pharm. Co., Ltd.; Korea Research Institute of Chemical Technology

US Patent


Assay Description
The following experiment was performed to evaluate the ability of [1,2,4]triazolo[4,3-a]quinoxaline derivative of the present invention to inhibit th...

US Patent US11028090 (2021)


BindingDB Entry DOI: 10.7270/Q22J6G0T
More data for this
Ligand-Target Pair