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BDBM341648 6-chloro-5-(2-(5-(3-fluorothiophen-2-yl)-7,8-dihydro-thiazolo[2',3':2,3]imidazo[4,5-c]pyridin-6(5H)-yl)-2-oxoethoxy)-N,N-dimethylpicolinamide::US9765092, Example 6.8.2

SMILES: CN(C)C(=O)c1ccc(OCC(=O)N2CCc3nc4sccn4c3C2c2sccc2F)c(Cl)n1

InChI Key: InChIKey=KAYDRBVDKYSCQI-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 341648   
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
Tryptophan 5-monooxygenase 1


(Homo sapiens (Human))
BDBM341648
PNG
(6-chloro-5-(2-(5-(3-fluorothiophen-2-yl)-7,8-dihyd...)
Show SMILES CN(C)C(=O)c1ccc(OCC(=O)N2CCc3nc4sccn4c3C2c2sccc2F)c(Cl)n1
Show InChI InChI=1S/C22H19ClFN5O3S2/c1-27(2)21(31)14-3-4-15(20(23)25-14)32-11-16(30)28-7-5-13-17(29-8-10-34-22(29)26-13)18(28)19-12(24)6-9-33-19/h3-4,6,8-10,18H,5,7,11H2,1-2H3
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MMDB

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US Patent
n/an/a 5n/an/an/an/an/an/a



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
To generate the enzyme, full length human TPH1 is cloned into the plasmid pET20b(+) (Novagen) and expressed in E. coli. The bacterial cells are ruptu...


US Patent US9765092 (2017)

More data for this
Ligand-Target Pair