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BDBM341347 N-(6-chloro-5-(2-(5-(4-chloro-2-fluorophenyl)-2-methyl-7,8-dihydro-[1,3,4]thiadiazolo[2',3':2,3]imidazo[4,5-c]pyridin-6(5H)-yl)-2-oxoethoxy)pyridin-2-yl)methanesulfonamide::US9765092, Example 1.4.39

SMILES: Cc1nn2c3C(N(CCc3nc2s1)C(=O)COc1ccc(NS(C)(=O)=O)nc1Cl)c1ccc(Cl)cc1F

InChI Key: InChIKey=WVDLBJODMXJEBA-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 341347   
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-hydroxylase 1


(Homo sapiens (Human))
BDBM341347
PNG
(N-(6-chloro-5-(2-(5-(4-chloro-2-fluorophenyl)-2-me...)
Show SMILES Cc1nn2c3C(N(CCc3nc2s1)C(=O)COc1ccc(NS(C)(=O)=O)nc1Cl)c1ccc(Cl)cc1F
Show InChI InChI=1S/C22H19Cl2FN6O4S2/c1-11-28-31-20-15(26-22(31)36-11)7-8-30(19(20)13-4-3-12(23)9-14(13)25)18(32)10-35-16-5-6-17(27-21(16)24)29-37(2,33)34/h3-6,9,19H,7-8,10H2,1-2H3,(H,27,29)
PDB
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)


BindingDB Entry DOI: 10.7270/Q21N838B
More data for this
Ligand-Target Pair