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BDBM245149 US9428460, 5

SMILES: Fc1cccc2c(O[C@H]3CC[C@H](CNC(=O)c4ccno4)CC3)ccnc12

InChI Key: InChIKey=BRYFIQMLWZDFSY-HDJSIYSDSA-N

Data: 1 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 1 hit for monomerid = 245149   
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))
BDBM245149
PNG
(US9428460, 5)
Show SMILES Fc1cccc2c(O[C@H]3CC[C@H](CNC(=O)c4ccno4)CC3)ccnc12
Show InChI InChI=1S/C20H20FN3O3/c21-16-3-1-2-15-17(8-10-22-19(15)16)26-14-6-4-13(5-7-14)12-23-20(25)18-9-11-24-27-18/h1-3,8-11,13-14H,4-7,12H2,(H,23,25)/t13-,14-
PDB

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 460n/an/an/an/an/an/a



BAYER PHARMA AKTIENGESELLSCHAFT

US Patent


Assay Description
For determining the androgen receptor-dependent transcription, a cellular assay system was used, consisting of PC-3 cells (Kaighn et al., Invest. Uro...


US Patent US9428460 (2016)


BindingDB Entry DOI: 10.7270/Q25719Z7
More data for this
Ligand-Target Pair