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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 = 'BDBM50167757'   
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))
BDBM50167757
PNG
(CHEMBL3797766)
Show SMILES N[C@@H](Cc1ccc(cc1)C(=O)\N=C(/N)NCc1c(Oc2ccccc2)cccc1N1CCCCCC1)C(O)=O |r|
Show InChI InChI=1S/C30H35N5O4/c31-25(29(37)38)19-21-13-15-22(16-14-21)28(36)34-30(32)33-20-24-26(35-17-6-1-2-7-18-35)11-8-12-27(24)39-23-9-4-3-5-10-23/h3-5,8-16,25H,1-2,6-7,17-20,31H2,(H,37,38)(H3,32,33,34,36)/t25-/m0/s1
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Article
PubMed
n/an/a 13n/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