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Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Tryptophan 5-hydroxylase 2' AND taxid = 9606   
Target
(Institution)
LigandTarget
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 2


(Homo sapiens)
BDBM50243617
PNG
((S)-2-Amino-3-(4-{2-amino-6-[2,2,2-trifluoro-1-(3'...)
Show SMILES Cc1cccc(c1)-c1ccccc1C(Oc1cc(nc(N)n1)-c1ccc(C[C@H](N)C(O)=O)cc1)C(F)(F)F
Show InChI InChI=1S/C28H25F3N4O3/c1-16-5-4-6-19(13-16)20-7-2-3-8-21(20)25(28(29,30)31)38-24-15-23(34-27(33)35-24)18-11-9-17(10-12-18)14-22(32)26(36)37/h2-13,15,22,25H,14,32H2,1H3,(H,36,37)(H2,33,34,35)/t22-,25?/m0/s1
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Article
PubMed
n/an/an/an/a 560n/an/an/an/a



Princ

Curated by ChEMBL


Assay Description
Inhibition of TPH2 in human BON cells assessed as inhibition of serotonin biosynthesis


Citation and Details
More data for this
Ligand-Target Pair
Tryptophan 5-hydroxylase 2


(Homo sapiens)
BDBM50243618
PNG
((2S)-2-amino-3-(4-(2-amino-6-(2,2,2-trifluoro-1-(2...)
Show SMILES N[C@@H](Cc1ccc(cc1)-c1cc(OC(c2ccccc2-c2ccco2)C(F)(F)F)nc(N)n1)C(O)=O
Show InChI InChI=1S/C25H21F3N4O4/c26-25(27,28)22(17-5-2-1-4-16(17)20-6-3-11-35-20)36-21-13-19(31-24(30)32-21)15-9-7-14(8-10-15)12-18(29)23(33)34/h1-11,13,18,22H,12,29H2,(H,33,34)(H2,30,31,32)/t18-,22?/m0/s1
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Article
PubMed
n/an/an/an/a 800n/an/an/an/a



Princ

Curated by ChEMBL


Assay Description
Inhibition of TPH2 in human BON cells assessed as inhibition of serotonin biosynthesis


Citation and Details
More data for this
Ligand-Target Pair
Tryptophan 5-hydroxylase 2


(Homo sapiens)
BDBM50243619
PNG
((S) -2-amino-3-[4-(2-amino-6-[2,2,2-trifluoro-1-(2...)
Show SMILES N[C@@H](Cc1ccc(cc1)-c1cc(OC(c2ccccc2-n2ccc(n2)C(F)(F)F)C(F)(F)F)nc(N)n1)C(O)=O
Show InChI InChI=1S/C25H20F6N6O3/c26-24(27,28)19-9-10-37(36-19)18-4-2-1-3-15(18)21(25(29,30)31)40-20-12-17(34-23(33)35-20)14-7-5-13(6-8-14)11-16(32)22(38)39/h1-10,12,16,21H,11,32H2,(H,38,39)(H2,33,34,35)/t16-,21?/m0/s1
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Article
PubMed
n/an/an/an/a 750n/an/an/an/a



Princ

Curated by ChEMBL


Assay Description
Inhibition of TPH2 in human BON cells assessed as inhibition of serotonin biosynthesis


Citation and Details
More data for this
Ligand-Target Pair
Tryptophan 5-hydroxylase 2


(Homo sapiens)
BDBM50243655
PNG
((2S)-2-amino-3-(4-(2-amino-6-(2,2,2-trifluoro-1-(3...)
Show SMILES N[C@@H](Cc1ccc(cc1)-c1cc(OC(c2sccc2-c2ccco2)C(F)(F)F)nc(N)n1)C(O)=O
Show InChI InChI=1S/C23H19F3N4O4S/c24-23(25,26)20(19-14(7-9-35-19)17-2-1-8-33-17)34-18-11-16(29-22(28)30-18)13-5-3-12(4-6-13)10-15(27)21(31)32/h1-9,11,15,20H,10,27H2,(H,31,32)(H2,28,29,30)/t15-,20?/m0/s1
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n/an/an/an/a 1.19E+3n/an/an/an/a



Princ

Curated by ChEMBL


Assay Description
Inhibition of TPH2 in human BON cells assessed as inhibition of serotonin biosynthesis


Citation and Details
More data for this
Ligand-Target Pair