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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50240197   
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
Focal adhesion kinase 1


(Homo sapiens (Human))
BDBM50240197
PNG
(CHEMBL4068745)
Show SMILES S=c1oc(nn1CN1CCN(CC1)c1ccccn1)-c1ccc2OCCOc2c1
Show InChI InChI=1S/C20H21N5O3S/c29-20-25(14-23-7-9-24(10-8-23)18-3-1-2-6-21-18)22-19(28-20)15-4-5-16-17(13-15)27-12-11-26-16/h1-6,13H,7-12,14H2
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 2.45E+3n/an/an/an/an/an/a



Nanjing University

Curated by ChEMBL


Assay Description
Inhibitory activity was determined against HSV-1 Ribonucleoside diphosphate reductase


Bioorg Med Chem 25: 2593-2600 (2017)


Article DOI: 10.1016/j.bmc.2017.03.038
BindingDB Entry DOI: 10.7270/Q2XP772B
More data for this
Ligand-Target Pair