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SMILES: CCNc1cnc2ccc(cc2c1OC)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2F)c1

InChI Key: InChIKey=NDKWTLHRUYMVIA-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50230922   
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 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))		BDBM50230922
PNG
(CHEMBL4101664)
Show SMILES CCNc1cnc2ccc(cc2c1OC)-c1cnc(OC)c(NS(=O)(=O)c2ccc(F)cc2F)c1
Show InChI InChI=1S/C24H22F2N4O4S/c1-4-27-21-13-28-19-7-5-14(9-17(19)23(21)33-2)15-10-20(24(34-3)29-12-15)30-35(31,32)22-8-6-16(25)11-18(22)26/h5-13,27,30H,4H2,1-3H3
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PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 9.40n/an/an/an/an/an/a



Hangzhou Xixi Hospital

Curated by ChEMBL


Assay Description
Inhibition of PI3K p110alpha/p85alpha (unknown origin) using PIP2 as substrate after 1 hr by luminescent kinase-Glo assay

Eur J Med Chem 127: 509-520 (2017)


BindingDB Entry DOI: 10.7270/Q2CZ39DX
More data for this
Ligand-Target Pair