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BDBM50210532 (S)-Methyl 2-(2-((S)-2,6-dioxo-3-(3,4,5-trimethoxybenzamido)-piperidin-1-yl)acetamido)-4-methylpentanoate::(S)-methyl 2-(2-((S)-2,6-dioxo-3-(3,4,5-trimethoxybenzamido)piperidin-1-yl)acetamido)-4-methylpentanoate::CHEMBL246991

SMILES: COC(=O)[C@H](CC(C)C)NC(=O)CN1C(=O)CC[C@H](NC(=O)c2cc(OC)c(OC)c(OC)c2)C1=O

InChI Key: InChIKey=HCTDCXATPFTQBT-HOTGVXAUSA-N

Data: 3 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50210532   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Aminopeptidase N


(Sus scrofa (Pig))
BDBM50210532
PNG
((S)-Methyl 2-(2-((S)-2,6-dioxo-3-(3,4,5-trimethoxy...)
Show SMILES COC(=O)[C@H](CC(C)C)NC(=O)CN1C(=O)CC[C@H](NC(=O)c2cc(OC)c(OC)c(OC)c2)C1=O
Show InChI InChI=1S/C24H33N3O9/c1-13(2)9-16(24(32)36-6)25-19(28)12-27-20(29)8-7-15(23(27)31)26-22(30)14-10-17(33-3)21(35-5)18(11-14)34-4/h10-11,13,15-16H,7-9,12H2,1-6H3,(H,25,28)(H,26,30)/t15-,16-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 4.62E+4n/an/an/an/an/an/a



Shandong University

Curated by ChEMBL


Assay Description
Inhibition of pig kidney microsomal aminopeptidase assessed as liberation of p-nitroanilide


Bioorg Med Chem Lett 17: 2935-8 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.095
BindingDB Entry DOI: 10.7270/Q2HT2P11
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))
BDBM50210532
PNG
((S)-Methyl 2-(2-((S)-2,6-dioxo-3-(3,4,5-trimethoxy...)
Show SMILES COC(=O)[C@H](CC(C)C)NC(=O)CN1C(=O)CC[C@H](NC(=O)c2cc(OC)c(OC)c(OC)c2)C1=O
Show InChI InChI=1S/C24H33N3O9/c1-13(2)9-16(24(32)36-6)25-19(28)12-27-20(29)8-7-15(23(27)31)26-22(30)14-10-17(33-3)21(35-5)18(11-14)34-4/h10-11,13,15-16H,7-9,12H2,1-6H3,(H,25,28)(H,26,30)/t15-,16-/m0/s1
PDB
MMDB

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KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.80E+3n/an/an/an/an/an/a



Shandong University

Curated by ChEMBL


Assay Description
Inhibition of MMP2 after 30 mins


Bioorg Med Chem Lett 17: 2935-8 (2007)


Article DOI: 10.1016/j.bmcl.2006.12.095
BindingDB Entry DOI: 10.7270/Q2HT2P11
More data for this
Ligand-Target Pair
Aminopeptidase N


(Sus scrofa (Pig))
BDBM50210532
PNG
((S)-Methyl 2-(2-((S)-2,6-dioxo-3-(3,4,5-trimethoxy...)
Show SMILES COC(=O)[C@H](CC(C)C)NC(=O)CN1C(=O)CC[C@H](NC(=O)c2cc(OC)c(OC)c(OC)c2)C1=O
Show InChI InChI=1S/C24H33N3O9/c1-13(2)9-16(24(32)36-6)25-19(28)12-27-20(29)8-7-15(23(27)31)26-22(30)14-10-17(33-3)21(35-5)18(11-14)34-4/h10-11,13,15-16H,7-9,12H2,1-6H3,(H,25,28)(H,26,30)/t15-,16-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 4.62E+4n/an/an/an/an/an/a



Shandong University

Curated by ChEMBL


Assay Description
Inhibition of pig kidney microsomes aminopeptidase N preincubated for 30 mins


Eur J Med Chem 44: 4819-25 (2009)


Article DOI: 10.1016/j.ejmech.2009.07.022
BindingDB Entry DOI: 10.7270/Q2251J73
More data for this
Ligand-Target Pair