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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Aminopeptidase N' and Ligand = 'BDBM50382924'   
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
Aminopeptidase N


(Homo sapiens (Human))
BDBM50382924
PNG
(CHEMBL2029397)
Show SMILES [#6]-[#6@@H](-[#8])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccccc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](-[#8])=O |r|
Show InChI InChI=1S/C30H50N12O8/c1-16(43)23(27(48)40-20(28(49)50)10-6-14-38-30(35)36)42-26(47)21(15-17-7-3-2-4-8-17)41-25(46)19(9-5-13-37-29(33)34)39-24(45)18(31)11-12-22(32)44/h2-4,7-8,16,18-21,23,43H,5-6,9-15,31H2,1H3,(H2,32,44)(H,39,45)(H,40,48)(H,41,46)(H,42,47)(H,49,50)(H4,33,34,37)(H4,35,36,38)/t16-,18+,19+,20+,21+,23+/m1/s1
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Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of human recombinant aminopeptidase N using Ala-Mca as substrate incubated for 10 mins prior to substrate addition measured for 40 mins by...


ACS Med Chem Lett 3: 20-24 (2012)


Article DOI: 10.1021/ml200182v
BindingDB Entry DOI: 10.7270/Q2P84CZ6
More data for this
Ligand-Target Pair
Aminopeptidase N


(Homo sapiens (Human))
BDBM50382924
PNG
(CHEMBL2029397)
Show SMILES [#6]-[#6@@H](-[#8])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccccc1)-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-[#6]-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](-[#8])=O |r|
Show InChI InChI=1S/C30H50N12O8/c1-16(43)23(27(48)40-20(28(49)50)10-6-14-38-30(35)36)42-26(47)21(15-17-7-3-2-4-8-17)41-25(46)19(9-5-13-37-29(33)34)39-24(45)18(31)11-12-22(32)44/h2-4,7-8,16,18-21,23,43H,5-6,9-15,31H2,1H3,(H2,32,44)(H,39,45)(H,40,48)(H,41,46)(H,42,47)(H,49,50)(H4,33,34,37)(H4,35,36,38)/t16-,18+,19+,20+,21+,23+/m1/s1
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PC cid
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UniChem

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Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Institute of Advanced Chemistry of Catalonia (IQAC-CSIC)

Curated by ChEMBL


Assay Description
Inhibition of human recombinant aminopeptidase N using AbzdR-G-L-EDDnp as substrate after 20 to 40 mins by fluorometry


Bioorg Med Chem Lett 25: 5190-3 (2015)


Article DOI: 10.1016/j.bmcl.2015.09.071
BindingDB Entry DOI: 10.7270/Q2FN182S
More data for this
Ligand-Target Pair