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Compile Data Set for Download or QSAR

Found 2 hits of ki for monomerid = 50098979   
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
Androgen receptor


(Rattus norvegicus (Rat))
BDBM50098979
PNG
(4-[3-(4-Fluoro-butyl)-4,4-dimethyl-2,5-dioxo-imida...)
Show SMILES CC1(C)N(CCCCF)C(=O)N(C1=O)c1ccc(C#N)c(c1)C(F)(F)F
Show InChI InChI=1S/C17H17F4N3O2/c1-16(2)14(25)24(15(26)23(16)8-4-3-7-18)12-6-5-11(10-22)13(9-12)17(19,20)21/h5-6,9H,3-4,7-8H2,1-2H3
PDB
MMDB

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PC cid
PC sid
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Similars

PubMed
213n/an/an/an/an/an/an/an/a



The University of Michigan Medical School

Curated by ChEMBL


Assay Description
Binding affinity against rat prostate cytosolic Androgen receptor using [3H]mibolerone as radioligand


Bioorg Med Chem Lett 11: 1045-7 (2001)


BindingDB Entry DOI: 10.7270/Q2SF2WQ5
More data for this
Ligand-Target Pair
Androgen receptor


(Rattus norvegicus (Rat))
BDBM50098979
PNG
(4-[3-(4-Fluoro-butyl)-4,4-dimethyl-2,5-dioxo-imida...)
Show SMILES CC1(C)N(CCCCF)C(=O)N(C1=O)c1ccc(C#N)c(c1)C(F)(F)F
Show InChI InChI=1S/C17H17F4N3O2/c1-16(2)14(25)24(15(26)23(16)8-4-3-7-18)12-6-5-11(10-22)13(9-12)17(19,20)21/h5-6,9H,3-4,7-8H2,1-2H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
214n/an/an/an/an/an/an/an/a



CSC-Scientific Computing Ltd.

Curated by ChEMBL


Assay Description
Inhibition of [3H]mibolerone binding to cytosolic androgen receptor of rat ventral prostate


J Med Chem 48: 917-25 (2005)


Article DOI: 10.1021/jm0495879
BindingDB Entry DOI: 10.7270/Q2SJ1PBD
More data for this
Ligand-Target Pair