Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 370.4 BDBM50049800

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Angiotensin-converting enzyme (Homo sapiens (Human))	BDBM50049800 (CHEMBL3322010) Show SMILES CC(C)[C@H](N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(O)=O |r| Show InChI InChI=1S/C16H30N6O4/c1-9(2)12(17)13(23)21-10(5-3-7-20-16(18)19)14(24)22-8-4-6-11(22)15(25)26/h9-12H,3-8,17H2,1-2H3,(H,21,23)(H,25,26)(H4,18,19,20)/t10-,11-,12-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.18E+6	n/a	n/a	n/a	n/a	n/a	n/a
Tianjin University Curated by ChEMBL					Assay Description Inhibition of ACE (unknown origin)				Eur J Med Chem 84: 100-6 (2014) Article DOI: 10.1016/j.ejmech.2014.07.015 BindingDB Entry DOI: 10.7270/Q29025F2
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