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BDBM50243766 2-((2S,6R)-2,6-dimethylmorpholino)-6-phenyl-7-(4-((4-(5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl)piperidin-1-yl)methyl)phenyl)pyrido[2,3-d]pyrimidine::CHEMBL448826

SMILES: C[C@H]1CN(C[C@@H](C)O1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1

InChI Key: InChIKey=ZOAZOJRIZYTSSL-WMPKNSHKSA-N

Data: 4 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50243766   
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
Serine/threonine-protein kinase AKT2


(Homo sapiens (Human))
BDBM50243766
PNG
(2-((2S,6R)-2,6-dimethylmorpholino)-6-phenyl-7-(4-(...)
Show SMILES C[C@H]1CN(C[C@@H](C)O1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1 |r|
Show InChI InChI=1S/C38H39N9O/c1-25-22-47(23-26(2)48-25)38-40-21-31-20-32(28-8-4-3-5-9-28)34(41-35(31)43-38)29-13-11-27(12-14-29)24-46-18-15-30(16-19-46)36-42-37(45-44-36)33-10-6-7-17-39-33/h3-14,17,20-21,25-26,30H,15-16,18-19,22-24H2,1-2H3,(H,42,44,45)/t25-,26+
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

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Similars

Article
PubMed
n/an/a 102n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.085
BindingDB Entry DOI: 10.7270/Q2F76CBC
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase AKT2


(Homo sapiens (Human))
BDBM50243766
PNG
(2-((2S,6R)-2,6-dimethylmorpholino)-6-phenyl-7-(4-(...)
Show SMILES C[C@H]1CN(C[C@@H](C)O1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1 |r|
Show InChI InChI=1S/C38H39N9O/c1-25-22-47(23-26(2)48-25)38-40-21-31-20-32(28-8-4-3-5-9-28)34(41-35(31)43-38)29-13-11-27(12-14-29)24-46-18-15-30(16-19-46)36-42-37(45-44-36)33-10-6-7-17-39-33/h3-14,17,20-21,25-26,30H,15-16,18-19,22-24H2,1-2H3,(H,42,44,45)/t25-,26+
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 184n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt2 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.085
BindingDB Entry DOI: 10.7270/Q2F76CBC
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (Human))
BDBM50243766
PNG
(2-((2S,6R)-2,6-dimethylmorpholino)-6-phenyl-7-(4-(...)
Show SMILES C[C@H]1CN(C[C@@H](C)O1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1 |r|
Show InChI InChI=1S/C38H39N9O/c1-25-22-47(23-26(2)48-25)38-40-21-31-20-32(28-8-4-3-5-9-28)34(41-35(31)43-38)29-13-11-27(12-14-29)24-46-18-15-30(16-19-46)36-42-37(45-44-36)33-10-6-7-17-39-33/h3-14,17,20-21,25-26,30H,15-16,18-19,22-24H2,1-2H3,(H,42,44,45)/t25-,26+
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 28n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation by HTRF assay


Bioorg Med Chem Lett 18: 4186-90 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.085
BindingDB Entry DOI: 10.7270/Q2F76CBC
More data for this
Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase


(Homo sapiens (Human))
BDBM50243766
PNG
(2-((2S,6R)-2,6-dimethylmorpholino)-6-phenyl-7-(4-(...)
Show SMILES C[C@H]1CN(C[C@@H](C)O1)c1ncc2cc(-c3ccccc3)c(nc2n1)-c1ccc(CN2CCC(CC2)c2nnc([nH]2)-c2ccccn2)cc1 |r|
Show InChI InChI=1S/C38H39N9O/c1-25-22-47(23-26(2)48-25)38-40-21-31-20-32(28-8-4-3-5-9-28)34(41-35(31)43-38)29-13-11-27(12-14-29)24-46-18-15-30(16-19-46)36-42-37(45-44-36)33-10-6-7-17-39-33/h3-14,17,20-21,25-26,30H,15-16,18-19,22-24H2,1-2H3,(H,42,44,45)/t25-,26+
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 42n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1 (unknown origin) phosphorylation in human by C33a cells by IPKA assay


Bioorg Med Chem Lett 18: 4186-90 (2008)


Article DOI: 10.1016/j.bmcl.2008.05.085
BindingDB Entry DOI: 10.7270/Q2F76CBC
More data for this
Ligand-Target Pair