BDBM50450889 CHEMBL4204498

SMILES: CC(C)n1cnc2c(Nc3cnn(C)c3)nc(N[C@H]3CN(C[C@@H]3F)C(=O)C=C)nc12

InChI Key: InChIKey=UDXYTRLHPLDWEW-KBPBESRZSA-N

Data: 1 KI

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 1 hit for monomerid = 50450889   

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
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50450889 (CHEMBL4204498) Show SMILES CC(C)n1cnc2c(Nc3cnn(C)c3)nc(N[C@H]3CN(C[C@@H]3F)C(=O)C=C)nc12 |r| Show InChI InChI=1S/C19H24FN9O/c1-5-15(30)28-8-13(20)14(9-28)24-19-25-17(23-12-6-22-27(4)7-12)16-18(26-19)29(10-21-16)11(2)3/h5-7,10-11,13-14H,1,8-9H2,2-4H3,(H2,23,24,25,26)/t13-,14-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	56	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wuxi AppTec Curated by ChEMBL					Assay Description Inhibition of EGFR T790M/L858R double mutant (unknown origin)				J Med Chem 60: 3002-3019 (2017) Article DOI: 10.1021/acs.jmedchem.6b01894 BindingDB Entry DOI: 10.7270/Q25X2CJZ
					More data for this Ligand-Target Pair