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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 = 'BDBM50234205'   
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))
BDBM50234205
PNG
(CHEMBL4088856)
Show SMILES Nc1nc(O[C@H](c2ccc(cc2)-c2ccc3cnccc3c2)C(F)(F)F)cc(n1)N1CCC2(CN[C@@H](C2)C(O)=O)CC1 |r|
Show InChI InChI=1S/C30H29F3N6O3/c31-30(32,33)26(19-3-1-18(2-4-19)20-5-6-22-16-35-10-7-21(22)13-20)42-25-14-24(37-28(34)38-25)39-11-8-29(9-12-39)15-23(27(40)41)36-17-29/h1-7,10,13-14,16,23,26,36H,8-9,11-12,15,17H2,(H,40,41)(H2,34,37,38)/t23-,26+/m0/s1
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Article
PubMed
n/an/a 25n/an/an/an/an/an/a



Karos Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of TPH1 (unknown origin)


Bioorg Med Chem Lett 27: 413-419 (2017)


Article DOI: 10.1016/j.bmcl.2016.12.053
BindingDB Entry DOI: 10.7270/Q21V5H7S
More data for this
Ligand-Target Pair