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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50188847   
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
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50188847
PNG
(CHEMBL3827056)
Show SMILES CN(Cc1nc2c(nc(nc2n1C)-c1cc(cc(c1)C(F)(F)F)C(F)(F)F)N1CCOCC1)c1ncc(cn1)C(=O)NO
Show InChI InChI=1S/C25H23F6N9O3/c1-38(23-32-10-14(11-33-23)22(41)37-42)12-17-34-18-20(39(17)2)35-19(36-21(18)40-3-5-43-6-4-40)13-7-15(24(26,27)28)9-16(8-13)25(29,30)31/h7-11,42H,3-6,12H2,1-2H3,(H,37,41)
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 30n/an/an/an/an/an/a



West China Hospital of Sichuan University

Curated by ChEMBL


Assay Description
Inhibition of full length C-terminal His/FLAG-tagged human recombinant HDAC1 expressed in baculovirus infected insect Sf9 cells using Ac-peptide-AMC ...


J Med Chem 59: 5488-504 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00579
BindingDB Entry DOI: 10.7270/Q2T155K0
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50188847
PNG
(CHEMBL3827056)
Show SMILES CN(Cc1nc2c(nc(nc2n1C)-c1cc(cc(c1)C(F)(F)F)C(F)(F)F)N1CCOCC1)c1ncc(cn1)C(=O)NO
Show InChI InChI=1S/C25H23F6N9O3/c1-38(23-32-10-14(11-33-23)22(41)37-42)12-17-34-18-20(39(17)2)35-19(36-21(18)40-3-5-43-6-4-40)13-7-15(24(26,27)28)9-16(8-13)25(29,30)31/h7-11,42H,3-6,12H2,1-2H3,(H,37,41)
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



West China Hospital of Sichuan University

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant human His-tagged p110 alpha/p85 alpha expressed in baculovirus expression system incubated for 1 hr by kinase-g...


J Med Chem 59: 5488-504 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00579
BindingDB Entry DOI: 10.7270/Q2T155K0
More data for this
Ligand-Target Pair