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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tryptophan 5-monooxygenase 1' and Ligand = 'BDBM341652'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Tryptophan 5-monooxygenase 1


(Homo sapiens (Human))
BDBM341652
PNG
(5-(6-(2-(2-chloro-4-(methylsulfonamido)phenoxy)-ac...)
Show SMILES CN(C)C(=O)c1cc(F)c(s1)C1N(CCc2nc3sccn3c12)C(=O)COc1ccc(NS(C)(=O)=O)cc1Cl
Show InChI InChI=1S/C24H23ClFN5O5S3/c1-29(2)23(33)18-11-15(26)22(38-18)21-20-16(27-24-31(20)8-9-37-24)6-7-30(21)19(32)12-36-17-5-4-13(10-14(17)25)28-39(3,34)35/h4-5,8-11,21,28H,6-7,12H2,1-3H3
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PC cid
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Article
US Patent
n/an/a 2n/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)


Article DOI: 10.1021/bi060173m
More data for this
Ligand-Target Pair