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BDBM50200092 4-(4-(3-fluoro-4-hydroxyphenyl)hexan-3-yl)benzene-1,2-diol::CHEMBL216660::NSC-32082

SMILES: CCC(C(CC)c1ccc(O)c(F)c1)c1ccc(O)c(O)c1

InChI Key: InChIKey=KQEVCJREQULIOL-UHFFFAOYSA-N

Data: 1 IC50

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Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50200092   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Testis-specific androgen-binding protein


(Homo sapiens (Human))
BDBM50200092
PNG
(4-(4-(3-fluoro-4-hydroxyphenyl)hexan-3-yl)benzene-...)
Show SMILES CCC(C(CC)c1ccc(O)c(F)c1)c1ccc(O)c(O)c1
Show InChI InChI=1S/C18H21FO3/c1-3-13(11-5-7-16(20)15(19)9-11)14(4-2)12-6-8-17(21)18(22)10-12/h5-10,13-14,20-22H,3-4H2,1-2H3
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.04E+4n/an/an/an/an/an/a



University of British Columbia

Curated by ChEMBL


Assay Description
Displacement of [3H]DHT from human SHBG


J Med Chem 49: 7466-78 (2006)


Article DOI: 10.1021/jm060961+
BindingDB Entry DOI: 10.7270/Q23X87G2
More data for this
Ligand-Target Pair