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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sepiapterin reductase' and Ligand = 'BDBM50515145'   
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
Sepiapterin reductase


(Homo sapiens (Human))		BDBM50515145
PNG
(CHEMBL4556522)
Show SMILES Oc1cc(Cl)cc(Cl)c1C(=O)N1CCC2(CC2)C1
Show InChI InChI=1S/C13H13Cl2NO2/c14-8-5-9(15)11(10(17)6-8)12(18)16-4-3-13(7-16)1-2-13/h5-6,17H,1-4,7H2
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 980n/an/an/an/an/an/a



Gr�nenthal GmbH

Curated by ChEMBL


Assay Description
Inhibition of TNAS binding to human sepiapterin reductase by 19F-NMR spectra analysis

J Med Chem 62: 6391-6397 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00218
BindingDB Entry DOI: 10.7270/Q2JW8J6W
More data for this
Ligand-Target Pair