BDBM50085452 (S)-2-[((S)-6-Amino-2-methanesulfonylamino-hexanoylamino)-methyl]-3-{1-[(S)-1-carboxy-2-(4-hydroxy-phenyl)-ethylcarbamoyl]-cyclopentyl}-propionic acid::CHEMBL42583::Sampatrilat

SMILES: CS(=O)(=O)N[C@@H](CCCCN)C(=O)NC[C@H](CC1(CCCC1)C(=O)N[C@@H](Cc2ccc(cc2)O)C(=O)O)C(=O)O

InChI Key: InChIKey=LPUDGHQMOAHMMF-UHFFFAOYSA-N

Data: 2 KI  6 IC50

PDB links: 3 PDB IDs match this monomer.

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 8 hits for monomerid = 50085452   

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 (Human)	BDBM50085452 (Sampatrilat | (S)-2-[((S)-6-Amino-2-methanesulfony...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
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Angiotensin-converting enzyme (Rabbit)	BDBM50085452 (Sampatrilat | (S)-2-[((S)-6-Amino-2-methanesulfony...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
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Neprilysin (Rat)	BDBM50085452 (Sampatrilat | (S)-2-[((S)-6-Amino-2-methanesulfony...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
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Neprilysin (Human)	BDBM50085452 (Sampatrilat | (S)-2-[((S)-6-Amino-2-methanesulfony...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.600	n/a	n/a	n/a	n/a	n/a	n/a
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Natriuretic peptides A (Human)	BDBM50085452 (Sampatrilat | (S)-2-[((S)-6-Amino-2-methanesulfony...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.40	n/a	n/a	n/a	n/a	n/a	n/a
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Endothelin-converting enzyme 1 (Human)	BDBM50085452 (Sampatrilat | (S)-2-[((S)-6-Amino-2-methanesulfony...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Angiotensin-converting enzyme (Human)	BDBM50085452 (Sampatrilat | (S)-2-[((S)-6-Amino-2-methanesulfony...) Show SMILES Show InChI	GoogleScholar	UniChem		14	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Angiotensin-converting enzyme (Human)	BDBM50085452 (Sampatrilat | (S)-2-[((S)-6-Amino-2-methanesulfony...) Show SMILES Show InChI	GoogleScholar	UniChem		172	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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