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Compile Data Set for Download or QSAR

Found 1 hit of ki for monomerid = 50151138   
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
Steryl-sulfatase


(Homo sapiens (Human))
BDBM50151138
PNG
((2-Adamantan-1-yl-4-oxo-4H-chromen-6-yl)-acetic ac...)
Show SMILES OC(=O)Cc1ccc2oc(cc(=O)c2c1)C12CC3CC(CC(C3)C1)C2 |TLB:22:21:24:16.17.18,22:17:24:23.21.20,THB:20:19:16:23.21.22,20:21:16:24.19.18|
Show InChI InChI=1S/C21H22O4/c22-17-8-19(21-9-13-3-14(10-21)5-15(4-13)11-21)25-18-2-1-12(6-16(17)18)7-20(23)24/h1-2,6,8,13-15H,3-5,7,9-11H2,(H,23,24)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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DrugBank
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
>5.00E+4n/an/an/an/an/an/an/an/a



Novartis Institute for Biomedical Research Vienna

Curated by ChEMBL


Assay Description
Inhibitory activity against human steroid sulfatase


J Med Chem 47: 4268-76 (2004)


Article DOI: 10.1021/jm0407916
BindingDB Entry DOI: 10.7270/Q2XW4KK4
More data for this
Ligand-Target Pair