BDBM298326 US10123984, Example 16::US10744104, Example 16

SMILES: CC(C)([C@H](C[C@@H](CO)C(O)=O)NC(=O)C(O)=O)c1ccc(cc1)-c1ccccc1

InChI Key: InChIKey=CEMQTZWNFAVGNN-WMZOPIPTSA-N

Data: 2 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 2 hits for monomerid = 298326   

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
Neprilysin (Homo sapiens (Human))	BDBM298326 (US10123984, Example 16 | US10744104, Example 16) Show SMILES CC(C)([C@H](C[C@@H](CO)C(O)=O)NC(=O)C(O)=O)c1ccc(cc1)-c1ccccc1 |r| Show InChI InChI=1S/C22H25NO6/c1-22(2,17-10-8-15(9-11-17)14-6-4-3-5-7-14)18(23-19(25)21(28)29)12-16(13-24)20(26)27/h3-11,16,18,24H,12-13H2,1-2H3,(H,23,25)(H,26,27)(H,28,29)/t16-,18-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	3.55	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Theravance Biopharma R&D IP, LLC US Patent					Assay Description The assays were performed in 384-well white opaque plates at 37° C. using the fluorogenic peptide substrates at a concentration of 10 μM in Assa...				US Patent US10744104 (2020)
					More data for this Ligand-Target Pair
Neprilysin (Homo sapiens (Human))	BDBM298326 (US10123984, Example 16 | US10744104, Example 16) Show SMILES CC(C)([C@H](C[C@@H](CO)C(O)=O)NC(=O)C(O)=O)c1ccc(cc1)-c1ccccc1 |r| Show InChI InChI=1S/C22H25NO6/c1-22(2,17-10-8-15(9-11-17)14-6-4-3-5-7-14)18(23-19(25)21(28)29)12-16(13-24)20(26)27/h3-11,16,18,24H,12-13H2,1-2H3,(H,23,25)(H,26,27)(H,28,29)/t16-,18-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	3.55	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
THERAVANCE BIOPHARMA R&D IP, LLC US Patent					Assay Description The assays were performed in 384-well white opaque plates at 37° C. using the fluorogenic peptide substrates at a concentration of 10 μM in Assa...				US Patent US10123984 (2018) BindingDB Entry DOI: 10.7270/Q2KK9DVB
					More data for this Ligand-Target Pair