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Articleid 50029542

Compile data set for download or QSAR
Found 3 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Neprilysin


(Rattus norvegicus (Rat))		BDBM50064106
PNG
(CGS-26303 | CHEMBL290698 | {[(R)-2-Biphenyl-4-yl-1...)
Show SMILES OP(O)(=O)CN[C@@H](Cc1ccc(cc1)-c1ccccc1)c1nnn[nH]1
Show InChI InChI=1S/C16H18N5O3P/c22-25(23,24)11-17-15(16-18-20-21-19-16)10-12-6-8-14(9-7-12)13-4-2-1-3-5-13/h1-9,15,17H,10-11H2,(H2,22,23,24)(H,18,19,20,21)/t15-/m0/s1
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Article
n/an/a 930n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against neutral endopeptidase at 30 mg/kg dose

Bioorg Med Chem Lett 5: 151-154 (1995)


Article DOI: 10.1016/0960-894X(94)00475-U
BindingDB Entry DOI: 10.7270/Q2B85831
More data for this
Ligand-Target Pair
Endothelin-converting enzyme 1


(Rattus norvegicus (Rat))		BDBM50064106
PNG
(CGS-26303 | CHEMBL290698 | {[(R)-2-Biphenyl-4-yl-1...)
Show SMILES OP(O)(=O)CN[C@@H](Cc1ccc(cc1)-c1ccccc1)c1nnn[nH]1
Show InChI InChI=1S/C16H18N5O3P/c22-25(23,24)11-17-15(16-18-20-21-19-16)10-12-6-8-14(9-7-12)13-4-2-1-3-5-13/h1-9,15,17H,10-11H2,(H2,22,23,24)(H,18,19,20,21)/t15-/m0/s1
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Article
n/an/a 1.10E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against endothelin-converting enzyme

Bioorg Med Chem Lett 5: 151-154 (1995)


Article DOI: 10.1016/0960-894X(94)00475-U
BindingDB Entry DOI: 10.7270/Q2B85831
More data for this
Ligand-Target Pair
Neprilysin


(Homo sapiens (Human))		BDBM50285334
PNG
((S)-3-Biphenyl-4-yl-2-(phosphonomethyl-amino)-prop...)
Show SMILES OC(=O)[C@H](Cc1ccc(cc1)-c1ccccc1)NCP(O)(O)=O
Show InChI InChI=1S/C16H18NO5P/c18-16(19)15(17-11-23(20,21)22)10-12-6-8-14(9-7-12)13-4-2-1-3-5-13/h1-9,15,17H,10-11H2,(H,18,19)(H2,20,21,22)/t15-/m0/s1
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Article
n/an/a 1.50E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against neutral endopeptidase at 30 mg/kg dose

Bioorg Med Chem Lett 5: 151-154 (1995)


Article DOI: 10.1016/0960-894X(94)00475-U
BindingDB Entry DOI: 10.7270/Q2B85831
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%