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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Androgen receptor' and Ligand = 'BDBM50051054'   
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


(Homo sapiens (Human))
BDBM50051054
PNG
(CHEMBL3317457)
Show SMILES Fc1ccc2cc([nH]c2c1)C(=O)N(Cc1ccco1)Cc1ccco1
Show InChI InChI=1S/C19H15FN2O3/c20-14-6-5-13-9-18(21-17(13)10-14)19(23)22(11-15-3-1-7-24-15)12-16-4-2-8-25-16/h1-10,21H,11-12H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 4.04E+3n/an/an/an/an/an/a



University of British Columbia

Curated by ChEMBL


Assay Description
Inhibition of androgen receptor binding function 3 in eGFP-expressing human LNCAP cells containing androgen-responsive probasin-derived promoter asse...


J Med Chem 57: 6867-72 (2014)


Article DOI: 10.1021/jm500684r
BindingDB Entry DOI: 10.7270/Q29S1SNR
More data for this
Ligand-Target Pair
Androgen receptor


(Homo sapiens (Human))
BDBM50051054
PNG
(CHEMBL3317457)
Show SMILES Fc1ccc2cc([nH]c2c1)C(=O)N(Cc1ccco1)Cc1ccco1
Show InChI InChI=1S/C19H15FN2O3/c20-14-6-5-13-9-18(21-17(13)10-14)19(23)22(11-15-3-1-7-24-15)12-16-4-2-8-25-16/h1-10,21H,11-12H2
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.48E+3n/an/an/an/an/an/a



University of British Columbia

Curated by ChEMBL


Assay Description
Inhibition of androgen receptor binding function 3 in human LNCAP cells containing androgen-responsive probasin-derived promoter assessed as reductio...


J Med Chem 57: 6867-72 (2014)


Article DOI: 10.1021/jm500684r
BindingDB Entry DOI: 10.7270/Q29S1SNR
More data for this
Ligand-Target Pair