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BDBM50393804 CHEMBL2159546

SMILES: FC(F)(F)c1cc(ccc1C1=NOC2CCCCCCC12)C#N

InChI Key: InChIKey=MZBCZNSSHQAROD-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50393804   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Androgen Receptor


(Homo sapiens (Human))
BDBM50393804
PNG
(CHEMBL2159546)
Show SMILES FC(F)(F)c1cc(ccc1C1=NOC2CCCCCCC12)C#N |t:11|
Show InChI InChI=1S/C17H17F3N2O/c18-17(19,20)14-9-11(10-21)7-8-12(14)16-13-5-3-1-2-4-6-15(13)23-22-16/h7-9,13,15H,1-6H2
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 646n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Displacement of [3H]R1881 from wild type human androgen receptor expressed in COS-1 cells co-transfected with pSG5 after 15 mins by scintillation ass...


J Med Chem 55: 6316-27 (2012)


Article DOI: 10.1021/jm300233k
BindingDB Entry DOI: 10.7270/Q2NS0W1N
More data for this
Ligand-Target Pair
Androgen Receptor


(Homo sapiens (Human))
BDBM50393804
PNG
(CHEMBL2159546)
Show SMILES FC(F)(F)c1cc(ccc1C1=NOC2CCCCCCC12)C#N |t:11|
Show InChI InChI=1S/C17H17F3N2O/c18-17(19,20)14-9-11(10-21)7-8-12(14)16-13-5-3-1-2-4-6-15(13)23-22-16/h7-9,13,15H,1-6H2
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 2.00E+3n/an/an/an/an/an/a



University of Eastern Finland

Curated by ChEMBL


Assay Description
Displacement of [3H]R1881 from wild type human androgen receptor expressed in COS-1 cells co-transfected with pSG5 after 15 mins by scintillation ass...


J Med Chem 55: 6316-27 (2012)


Article DOI: 10.1021/jm300233k
BindingDB Entry DOI: 10.7270/Q2NS0W1N
More data for this
Ligand-Target Pair