BDBM50185003 CHEMBL3824264::US10351548, Compound JJ31

SMILES: Fc1ccc(Cn2cccc(C(=O)Nc3ccc4NC(=O)\C(=C/c5cnc[nH]5)c4c3)c2=O)cc1F

InChI Key: InChIKey=DJFVVRAJTMRMJQ-GRSHGNNSSA-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 = 50185003   

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
3-phosphoinositide dependent protein kinase-1 (Homo sapiens (Human))	BDBM50185003 (CHEMBL3824264 | US10351548, Compound JJ31) Show SMILES Fc1ccc(Cn2cccc(C(=O)Nc3ccc4NC(=O)\C(=C/c5cnc[nH]5)c4c3)c2=O)cc1F Show InChI InChI=1S/C25H17F2N5O3/c26-20-5-3-14(8-21(20)27)12-32-7-1-2-17(25(32)35)23(33)30-15-4-6-22-18(9-15)19(24(34)31-22)10-16-11-28-13-29-16/h1-11,13H,12H2,(H,28,29)(H,30,33)(H,31,34)/b19-10-	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	512	n/a	n/a	n/a	n/a	n/a	n/a
International Society for Drug Development S.R.L. US Patent					Assay Description Factor IX is a key component of the plasma system that forms a fibrin clot at a site of vascular injury. The activity of Factor IXa is measured by mo...				US Patent US10351548 (2019) BindingDB Entry DOI: 10.7270/Q2XP7781
					More data for this Ligand-Target Pair
3-phosphoinositide dependent protein kinase-1 (Homo sapiens (Human))	BDBM50185003 (CHEMBL3824264 | US10351548, Compound JJ31) Show SMILES Fc1ccc(Cn2cccc(C(=O)Nc3ccc4NC(=O)\C(=C/c5cnc[nH]5)c4c3)c2=O)cc1F Show InChI InChI=1S/C25H17F2N5O3/c26-20-5-3-14(8-21(20)27)12-32-7-1-2-17(25(32)35)23(33)30-15-4-6-22-18(9-15)19(24(34)31-22)10-16-11-28-13-29-16/h1-11,13H,12H2,(H,28,29)(H,30,33)(H,31,34)/b19-10-	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	512	n/a	n/a	n/a	n/a	n/a	n/a
University of Pisa Curated by ChEMBL					Assay Description Inhibition of PDK1 (unknown origin) by FRET-based Z-lyte assay				Eur J Med Chem 118: 47-63 (2016) BindingDB Entry DOI: 10.7270/Q2F191NB
					More data for this Ligand-Target Pair