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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Androgen receptor (AR)' and Ligand = 'BDBM245166'   
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 (AR)


(Homo sapiens (Human))
BDBM245166
PNG
(US9428460, 22)
Show SMILES O=C(NC[C@H]1CC[C@@H](CC1)Oc1ccnc2ccccc12)c1ccc(cc1)C#N
Show InChI InChI=1S/C24H23N3O2/c25-15-17-5-9-19(10-6-17)24(28)27-16-18-7-11-20(12-8-18)29-23-13-14-26-22-4-2-1-3-21(22)23/h1-6,9-10,13-14,18,20H,7-8,11-12,16H2,(H,27,28)/t18-,20-
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 330n/an/an/an/an/a37



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