BDBM50107317 CHEMBL3601177

SMILES: Clc1ccc(cc1)C(=O)OC(C(=O)c1ccccc1)c1ccccc1

InChI Key: InChIKey=YTEZSLKJBXSBOP-UHFFFAOYSA-N

Data: 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 2 hits for monomerid = 50107317   

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))	BDBM50107317 (CHEMBL3601177) Show SMILES Clc1ccc(cc1)C(=O)OC(C(=O)c1ccccc1)c1ccccc1 Show InChI InChI=1S/C21H15ClO3/c22-18-13-11-17(12-14-18)21(24)25-20(16-9-5-2-6-10-16)19(23)15-7-3-1-4-8-15/h1-14,20H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	7.30E+5	n/a	n/a	n/a	n/a	n/a	n/a
Al-Zaytoonah University of Jordan Curated by ChEMBL					Assay Description Inhibition of PI3Kalpha H1047R mutant in human HCT116 cells assessed as cell growth inhibition after 24 hrs by MTT assay				Bioorg Med Chem Lett 25: 3120-4 (2015) BindingDB Entry DOI: 10.7270/Q2XW4MKJ
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human))	BDBM50107317 (CHEMBL3601177) Show SMILES Clc1ccc(cc1)C(=O)OC(C(=O)c1ccccc1)c1ccccc1 Show InChI InChI=1S/C21H15ClO3/c22-18-13-11-17(12-14-18)21(24)25-20(16-9-5-2-6-10-16)19(23)15-7-3-1-4-8-15/h1-14,20H	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	7.30E+5	n/a	n/a	n/a	n/a	n/a	n/a
Al-Zaytoonah University of Jordan Curated by ChEMBL					Assay Description Inhibition of PI3Kalpha in human HCT116 cells assessed as cell growth inhibition after 24 hrs by MTT assay				Bioorg Med Chem Lett 25: 3120-4 (2015) BindingDB Entry DOI: 10.7270/Q2XW4MKJ
					More data for this Ligand-Target Pair