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BDBM50457877 CHEMBL4215615

SMILES: C[C@H](C(=O)Nc1nc(C)c([nH]1)-c1ccc(Cl)c(c1)S(=O)(=O)NCCO)c1ccc(Cl)cc1

InChI Key: InChIKey=HQKUBQPEPHLGAZ-LBPRGKRZSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50457877   
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
Phosphatidylinositol 4-kinase beta


(Homo sapiens (Human))
BDBM50457877
PNG
(CHEMBL4215615)
Show SMILES C[C@H](C(=O)Nc1nc(C)c([nH]1)-c1ccc(Cl)c(c1)S(=O)(=O)NCCO)c1ccc(Cl)cc1 |r|
Show InChI InChI=1S/C21H22Cl2N4O4S/c1-12(14-3-6-16(22)7-4-14)20(29)27-21-25-13(2)19(26-21)15-5-8-17(23)18(11-15)32(30,31)24-9-10-28/h3-8,11-12,24,28H,9-10H2,1-2H3,(H2,25,26,27,29)/t12-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 71n/an/an/an/an/an/a



UCB Pharma

Curated by ChEMBL


Assay Description
Inhibition of PI4K3beta in human PBMC assessed as reduction in mitomycin-C treated human RPMI1788 cells-stimulated lymphocyte proliferation by measur...


J Med Chem 61: 6705-6723 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00521
BindingDB Entry DOI: 10.7270/Q2FF3W01
More data for this
Ligand-Target Pair
Phosphatidylinositol 4-kinase beta


(Homo sapiens (Human))
BDBM50457877
PNG
(CHEMBL4215615)
Show SMILES C[C@H](C(=O)Nc1nc(C)c([nH]1)-c1ccc(Cl)c(c1)S(=O)(=O)NCCO)c1ccc(Cl)cc1 |r|
Show InChI InChI=1S/C21H22Cl2N4O4S/c1-12(14-3-6-16(22)7-4-14)20(29)27-21-25-13(2)19(26-21)15-5-8-17(23)18(11-15)32(30,31)24-9-10-28/h3-8,11-12,24,28H,9-10H2,1-2H3,(H2,25,26,27,29)/t12-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 42n/an/an/an/an/an/a



UCB Pharma

Curated by ChEMBL


Assay Description
Inhibition of recombinant human full length GST-tagged PI4K3beta expressed in baculovirus expression system using PI lipid kinase substrate after 60 ...


J Med Chem 61: 6705-6723 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00521
BindingDB Entry DOI: 10.7270/Q2FF3W01
More data for this
Ligand-Target Pair