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SMILES: Cc1nn2c3C(N(CCc3nc2s1)C(=O)COc1ccc(cc1Cl)C(F)(F)F)c1ccc(Cl)nc1F

InChI Key: InChIKey=TYZVJHVECYFOCZ-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 341445   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Tryptophan 5-hydroxylase 1


(Homo sapiens (Human))		BDBM341445
PNG
(1-(5-(6-chloro-2-fluoropyridin-3-yl)-2-methyl-7,8-...)
Show SMILES Cc1nn2c3C(N(CCc3nc2s1)C(=O)COc1ccc(cc1Cl)C(F)(F)F)c1ccc(Cl)nc1F
Show InChI InChI=1S/C22H15Cl2F4N5O2S/c1-10-31-33-19-14(29-21(33)36-10)6-7-32(18(19)12-3-5-16(24)30-20(12)25)17(34)9-35-15-4-2-11(8-13(15)23)22(26,27)28/h2-5,8,18H,6-7,9H2,1H3
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US Patent
n/an/a 5n/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)


BindingDB Entry DOI: 10.7270/Q21N838B
More data for this
Ligand-Target Pair