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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50024765   
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
Aldo-keto reductase family 1 member C3


(Homo sapiens (Human))		BDBM50024765
PNG
(CHEMBL3337720)
Show SMILES OC(=O)\C=C\c1ccc(OC(=O)CCc2ccc(O)cc2)c(OCc2cccc(F)c2)c1
Show InChI InChI=1S/C25H21FO6/c26-20-3-1-2-19(14-20)16-31-23-15-18(7-12-24(28)29)6-11-22(23)32-25(30)13-8-17-4-9-21(27)10-5-17/h1-7,9-12,14-15,27H,8,13,16H2,(H,28,29)/b12-7+
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KEGG

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PC cid
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Similars
Article
PubMed
n/an/a 840n/an/an/an/an/an/a



Gifu Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of AKR1C3 (unknown origin) assessed as dehydrogenase activity of enzyme by NADPH fluorescence assay

Bioorg Med Chem 22: 5220-33 (2014)


Article DOI: 10.1016/j.bmc.2014.08.007
BindingDB Entry DOI: 10.7270/Q28P623F
More data for this
Ligand-Target Pair