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BDBM50298309 CHEMBL574533::ETP-7146::N-(3-methoxyphenyl)-1-methyl-6-(4-methylpiperazin-1-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine

SMILES: COc1cccc(Nc2nc(nc3n(C)ncc23)N2CCN(C)CC2)c1

InChI Key: InChIKey=OCGQAKYJZXVEPH-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50298309   
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
5-Hydroxytryptamine receptor 2C (5-HT2C)


(Homo sapiens (human))
BDBM50298309
PNG
(CHEMBL574533 | ETP-7146 | N-(3-methoxyphenyl)-1-me...)
Show SMILES COc1cccc(Nc2nc(nc3n(C)ncc23)N2CCN(C)CC2)c1
Show InChI InChI=1S/C18H23N7O/c1-23-7-9-25(10-8-23)18-21-16(15-12-19-24(2)17(15)22-18)20-13-5-4-6-14(11-13)26-3/h4-6,11-12H,7-10H2,1-3H3,(H,20,21,22)
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 7.80n/an/an/an/an/an/a



Institute of Science and Technology

Curated by ChEMBL


Assay Description
Displacement of [3H]Mesulergine from human recombinant serotonin 5-HT2C expressed in CHO-K1 cells


Bioorg Med Chem 17: 4559-68 (2009)


Article DOI: 10.1016/j.bmc.2009.05.003
BindingDB Entry DOI: 10.7270/Q20V8CV1
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM50298309
PNG
(CHEMBL574533 | ETP-7146 | N-(3-methoxyphenyl)-1-me...)
Show SMILES COc1cccc(Nc2nc(nc3n(C)ncc23)N2CCN(C)CC2)c1
Show InChI InChI=1S/C18H23N7O/c1-23-7-9-25(10-8-23)18-21-16(15-12-19-24(2)17(15)22-18)20-13-5-4-6-14(11-13)26-3/h4-6,11-12H,7-10H2,1-3H3,(H,20,21,22)
PDB
MMDB

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DrugBank
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 9.20E+3n/an/an/an/an/an/a



Spanish National Cancer Research Center (CNIO)



Assay Description
Kinase assay using PI3K.


J Biol Chem 284: 28392-400 (2009)


Article DOI: 10.1074/jbc.M109.038984
BindingDB Entry DOI: 10.7270/Q2N01556
More data for this
Ligand-Target Pair