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Compile Data Set for Download or QSAR

Found 1 hit with Last Name = 'graziani' and Initial = 'g'   
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
Poly [ADP-ribose] polymerase 1


(Homo sapiens (Human))
BDBM50260175
PNG
(CHEMBL4088384)
Show SMILES O=C(NCCN1CCC(Cc2ccccc2)CC1)c1cc2[nH]c(=O)c3ccccc3c2s1
Show InChI InChI=1S/C26H27N3O2S/c30-25-21-9-5-4-8-20(21)24-22(28-25)17-23(32-24)26(31)27-12-15-29-13-10-19(11-14-29)16-18-6-2-1-3-7-18/h1-9,17,19H,10-16H2,(H,27,31)(H,28,30)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 223n/an/an/an/an/an/a



Regina Elena National Cancer Institute

Curated by ChEMBL


Assay Description
Displacement of [3H]R-1881 from Androgen receptor of PC3-AR cells


J Med Chem 60: 3626-3635 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01563
BindingDB Entry DOI: 10.7270/Q2TH8Q56
More data for this
Ligand-Target Pair