BDBM50230173 CHEMBL4101918

SMILES: Nc1n[nH]c2cccc(-c3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc5OCOc5c4)cc3)c12

InChI Key: InChIKey=INFKEXSACBWFSL-UHFFFAOYSA-N

Data: 3 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 = 50230173   

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
Ephrin type-B receptor 4 (Homo sapiens (Human))	BDBM50230173 (CHEMBL4101918) Show SMILES Nc1n[nH]c2cccc(-c3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc5OCOc5c4)cc3)c12 Show InChI InChI=1S/C25H21N5O4/c26-22-21-17(2-1-3-18(21)29-30-22)14-4-6-15(7-5-14)27-23(31)25(10-11-25)24(32)28-16-8-9-19-20(12-16)34-13-33-19/h1-9,12H,10-11,13H2,(H,27,31)(H,28,32)(H3,26,29,30)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.30	n/a	n/a	n/a	n/a	n/a	n/a
Xi'an Jiaotong University Curated by ChEMBL					Assay Description Inhibition of EphB4 (unknown origin) after 60 mins by ADP-Glo assay				Eur J Med Chem 127: 275-285 (2017) BindingDB Entry DOI: 10.7270/Q2XW4N27
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50230173 (CHEMBL4101918) Show SMILES Nc1n[nH]c2cccc(-c3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc5OCOc5c4)cc3)c12 Show InChI InChI=1S/C25H21N5O4/c26-22-21-17(2-1-3-18(21)29-30-22)14-4-6-15(7-5-14)27-23(31)25(10-11-25)24(32)28-16-8-9-19-20(12-16)34-13-33-19/h1-9,12H,10-11,13H2,(H,27,31)(H,28,32)(H3,26,29,30)	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	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Xi'an Jiaotong University Curated by ChEMBL					Assay Description Inhibition of VEGFR2 (unknown origin) after 60 mins by ADP-Glo assay				Eur J Med Chem 127: 275-285 (2017) BindingDB Entry DOI: 10.7270/Q2XW4N27
					More data for this Ligand-Target Pair
Angiopoietin-1 receptor (Homo sapiens (Human))	BDBM50230173 (CHEMBL4101918) Show SMILES Nc1n[nH]c2cccc(-c3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc5OCOc5c4)cc3)c12 Show InChI InChI=1S/C25H21N5O4/c26-22-21-17(2-1-3-18(21)29-30-22)14-4-6-15(7-5-14)27-23(31)25(10-11-25)24(32)28-16-8-9-19-20(12-16)34-13-33-19/h1-9,12H,10-11,13H2,(H,27,31)(H,28,32)(H3,26,29,30)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	6.70	n/a	n/a	n/a	n/a	n/a	n/a
Xi'an Jiaotong University Curated by ChEMBL					Assay Description Inhibition of TIE-2 (unknown origin) after 60 mins by ADP-Glo assay				Eur J Med Chem 127: 275-285 (2017) BindingDB Entry DOI: 10.7270/Q2XW4N27
					More data for this Ligand-Target Pair