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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tryptophan 5-hydroxylase 1' and Ligand = 'BDBM50167393'   
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-hydroxylase 1


(Homo sapiens (Human))
BDBM50167393
PNG
(CHEMBL3799306)
Show SMILES N[C@@H](Cc1ccc(cc1)C(=O)\N=C(/N)NCc1c(Oc2ccccc2)cccc1N1CCCCC1)C(O)=O |r|
Show InChI InChI=1S/C29H33N5O4/c30-24(28(36)37)18-20-12-14-21(15-13-20)27(35)33-29(31)32-19-23-25(34-16-5-2-6-17-34)10-7-11-26(23)38-22-8-3-1-4-9-22/h1,3-4,7-15,24H,2,5-6,16-19,30H2,(H,36,37)(H3,31,32,33,35)/t24-/m0/s1
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Article
PubMed
n/an/a 26n/an/an/an/an/an/a



Karos Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of TPH1 (unknown origin)


Bioorg Med Chem Lett 26: 2855-2860 (2016)


Article DOI: 10.1016/j.bmcl.2016.04.057
BindingDB Entry DOI: 10.7270/Q2SN0BW3
More data for this
Ligand-Target Pair