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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sepiapterin reductase' and Ligand = 'BDBM50537654'   
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))		BDBM50537654
PNG
(CHEMBL4643587)
Show SMILES COc1ccc(O)c(c1)C(=O)c1cnc2n(nc(C)c2c1)-c1cccc(C)c1
Show InChI InChI=1S/C22H19N3O3/c1-13-5-4-6-16(9-13)25-22-18(14(2)24-25)10-15(12-23-22)21(27)19-11-17(28-3)7-8-20(19)26/h4-12,26H,1-3H3
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.90E+4n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at CB1 receptor by [35S]GTPgammaS binding assay

Bioorg Med Chem Lett 30: (2020)


Article DOI: 10.1016/j.bmcl.2019.126793
BindingDB Entry DOI: 10.7270/Q2Z89G99
More data for this
Ligand-Target Pair