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BDBM50051055 CHEMBL3318058

SMILES: CC(C)N(Cc1ccco1)C(=O)c1cc2cc(ccc2[nH]1)C(F)(F)F

InChI Key: InChIKey=PQHGXQQWWSLYNP-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 = 50051055   
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))
BDBM50051055
PNG
(CHEMBL3318058)
Show SMILES CC(C)N(Cc1ccco1)C(=O)c1cc2cc(ccc2[nH]1)C(F)(F)F
Show InChI InChI=1S/C18H17F3N2O2/c1-11(2)23(10-14-4-3-7-25-14)17(24)16-9-12-8-13(18(19,20)21)5-6-15(12)22-16/h3-9,11,22H,10H2,1-2H3
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 5.20E+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))
BDBM50051055
PNG
(CHEMBL3318058)
Show SMILES CC(C)N(Cc1ccco1)C(=O)c1cc2cc(ccc2[nH]1)C(F)(F)F
Show InChI InChI=1S/C18H17F3N2O2/c1-11(2)23(10-14-4-3-7-25-14)17(24)16-9-12-8-13(18(19,20)21)5-6-15(12)22-16/h3-9,11,22H,10H2,1-2H3
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 5.29E+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