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SMILES: CC(C)N(C)c1nc2cc(ccc2nc1-c1ccc(OC(F)(F)F)cc1)C(O)=O

InChI Key: InChIKey=HUUWVMRTOMEUIK-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 463534   
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
PAS domain-containing serine/threonine-protein kinase


(Homo sapiens (Human))		BDBM463534
PNG
(3-(Isopropyl(methyl)amino)-2-(4-(trifluoromethoxy)...)
Show SMILES CC(C)N(C)c1nc2cc(ccc2nc1-c1ccc(OC(F)(F)F)cc1)C(O)=O
Show InChI InChI=1S/C20H18F3N3O3/c1-11(2)26(3)18-17(12-4-7-14(8-5-12)29-20(21,22)23)24-15-9-6-13(19(27)28)10-16(15)25-18/h4-11H,1-3H3,(H,27,28)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<1.00E+3n/an/an/an/an/an/a



BioEnergenix LLC

US Patent


Assay Description
Compound screening was done via the following method. 10 mM stock solution of test compound in DMSO was prepared by dissolving test compound in DMSO ...

US Patent US10781185 (2020)

More data for this
Ligand-Target Pair