BDBM50351954 CHEMBL1822059

SMILES: Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccn2c1

InChI Key: InChIKey=DNCWCPDSMUNNAM-UHFFFAOYSA-N

Data: 1 KI  2 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 3 hits for monomerid = 50351954   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human))	BDBM50351954 (CHEMBL1822059) Show SMILES Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccn2c1 Show InChI InChI=1S/C18H12ClFN4O2S/c19-18-16(23-27(25,26)15-4-2-14(20)3-5-15)9-13(10-22-18)12-1-6-17-21-7-8-24(17)11-12/h1-11,23H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	23	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Amgen Inc. Curated by ChEMBL					Assay Description Inhibition of human PI3Kalpha using PI(4,5)P2 as substrate after 20 mins by alphascreen assay in presence of 20 uM ATP				J Med Chem 54: 5174-84 (2011) Article DOI: 10.1021/jm2004442 BindingDB Entry DOI: 10.7270/Q2V12567
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase (Homo sapiens (Human))	BDBM50351954 (CHEMBL1822059) Show SMILES Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccn2c1 Show InChI InChI=1S/C18H12ClFN4O2S/c19-18-16(23-27(25,26)15-4-2-14(20)3-5-15)9-13(10-22-18)12-1-6-17-21-7-8-24(17)11-12/h1-11,23H	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	574	n/a	n/a	n/a	n/a	n/a	n/a
Amgen Inc. Curated by ChEMBL					Assay Description Inhibition of PI3K-mediated Akt phosphorylation at Ser 473 in human U87MG cells after 2 hrs by alphascreen assay				J Med Chem 54: 5174-84 (2011) Article DOI: 10.1021/jm2004442 BindingDB Entry DOI: 10.7270/Q2V12567
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase mTOR (Homo sapiens (Human))	BDBM50351954 (CHEMBL1822059) Show SMILES Fc1ccc(cc1)S(=O)(=O)Nc1cc(cnc1Cl)-c1ccc2nccn2c1 Show InChI InChI=1S/C18H12ClFN4O2S/c19-18-16(23-27(25,26)15-4-2-14(20)3-5-15)9-13(10-22-18)12-1-6-17-21-7-8-24(17)11-12/h1-11,23H	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/a	n/a	229	n/a	n/a	n/a	n/a	n/a	n/a
Amgen Inc. Curated by ChEMBL					Assay Description Inhibition of recombinant N-terminal GST-tagged mTOR-mediated 4E-BP1 phosphorylation after 60 mins by TR-FRET assay				J Med Chem 54: 5174-84 (2011) Article DOI: 10.1021/jm2004442 BindingDB Entry DOI: 10.7270/Q2V12567
					More data for this Ligand-Target Pair