BDBM50006115 (R)-RETRO-THIORPHAN::(RETRO)N-(1-Mercaptomethyl-2-phenyl-ethyl)-malonamic acid::(S) N-(1-Mercaptomethyl-2-phenyl-ethyl)-malonamic acid::CHEMBL45412

SMILES: c1ccc(cc1)C[C@H](CS)NC(=O)CC(=O)O

InChI Key: InChIKey=REPVVNYZORKKPQ-UHFFFAOYSA-N

Data: 2 KI  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 4 hits for monomerid = 50006115   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Neprilysin (Rat)	BDBM50006115 ((RETRO)N-(1-Mercaptomethyl-2-phenyl-ethyl)-malonam...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
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Angiotensin-converting enzyme (Human)	BDBM50006115 ((RETRO)N-(1-Mercaptomethyl-2-phenyl-ethyl)-malonam...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.00E+9	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Neprilysin (Human)	BDBM50006115 ((RETRO)N-(1-Mercaptomethyl-2-phenyl-ethyl)-malonam...) Show SMILES Show InChI	GoogleScholar	UniChem		2.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Thermolysin (Bacillus thermoproteolyticus)	BDBM50006115 ((RETRO)N-(1-Mercaptomethyl-2-phenyl-ethyl)-malonam...) Show SMILES Show InChI	GoogleScholar	UniChem		2.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair