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BDBM50245247 CHEMBL452082::N-[(Hydroxyamino)carbonyl]-D-leucyl-Lphenylalanine methylamide

SMILES: CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CC(C)C)NC(=O)NO

InChI Key: InChIKey=RMPMGGGCHRCWIU-KGLIPLIRSA-N

Data: 6 IC50

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 6 hits for monomerid = 50245247   
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
Matrix metalloproteinase-9


(Homo sapiens (Human))
BDBM50245247
PNG
(CHEMBL452082 | N-[(Hydroxyamino)carbonyl]-D-leucyl...)
Show SMILES CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CC(C)C)NC(=O)NO |r|
Show InChI InChI=1S/C17H26N4O4/c1-11(2)9-13(20-17(24)21-25)16(23)19-14(15(22)18-3)10-12-7-5-4-6-8-12/h4-8,11,13-14,25H,9-10H2,1-3H3,(H,18,22)(H,19,23)(H2,20,21,24)/t13-,14+/m1/s1
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Article
PubMed
n/an/a 2.00E+5n/an/an/an/an/an/a



Università G. d'Annunzio

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MMP9


Eur J Med Chem 43: 1008-14 (2008)


Article DOI: 10.1016/j.ejmech.2007.07.002
BindingDB Entry DOI: 10.7270/Q23T9H1W
More data for this
Ligand-Target Pair
Interstitial collagenase


(Homo sapiens (Human))
BDBM50245247
PNG
(CHEMBL452082 | N-[(Hydroxyamino)carbonyl]-D-leucyl...)
Show SMILES CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CC(C)C)NC(=O)NO |r|
Show InChI InChI=1S/C17H26N4O4/c1-11(2)9-13(20-17(24)21-25)16(23)19-14(15(22)18-3)10-12-7-5-4-6-8-12/h4-8,11,13-14,25H,9-10H2,1-3H3,(H,18,22)(H,19,23)(H2,20,21,24)/t13-,14+/m1/s1
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n/an/a>3.00E+5n/an/an/an/an/an/a



Università G. d'Annunzio

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MMP1


Eur J Med Chem 43: 1008-14 (2008)


Article DOI: 10.1016/j.ejmech.2007.07.002
BindingDB Entry DOI: 10.7270/Q23T9H1W
More data for this
Ligand-Target Pair
Neutrophil collagenase


(Homo sapiens (Human))
BDBM50245247
PNG
(CHEMBL452082 | N-[(Hydroxyamino)carbonyl]-D-leucyl...)
Show SMILES CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CC(C)C)NC(=O)NO |r|
Show InChI InChI=1S/C17H26N4O4/c1-11(2)9-13(20-17(24)21-25)16(23)19-14(15(22)18-3)10-12-7-5-4-6-8-12/h4-8,11,13-14,25H,9-10H2,1-3H3,(H,18,22)(H,19,23)(H2,20,21,24)/t13-,14+/m1/s1
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n/an/a 1.50E+5n/an/an/an/an/an/a



Università G. d'Annunzio

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MMP8


Eur J Med Chem 43: 1008-14 (2008)


Article DOI: 10.1016/j.ejmech.2007.07.002
BindingDB Entry DOI: 10.7270/Q23T9H1W
More data for this
Ligand-Target Pair
Stromelysin-1


(Homo sapiens (Human))
BDBM50245247
PNG
(CHEMBL452082 | N-[(Hydroxyamino)carbonyl]-D-leucyl...)
Show SMILES CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CC(C)C)NC(=O)NO |r|
Show InChI InChI=1S/C17H26N4O4/c1-11(2)9-13(20-17(24)21-25)16(23)19-14(15(22)18-3)10-12-7-5-4-6-8-12/h4-8,11,13-14,25H,9-10H2,1-3H3,(H,18,22)(H,19,23)(H2,20,21,24)/t13-,14+/m1/s1
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n/an/a>3.00E+5n/an/an/an/an/an/a



Università G. d'Annunzio

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MMP3


Eur J Med Chem 43: 1008-14 (2008)


Article DOI: 10.1016/j.ejmech.2007.07.002
BindingDB Entry DOI: 10.7270/Q23T9H1W
More data for this
Ligand-Target Pair
Matrix metalloproteinase-7 (MMP7)


(Homo sapiens (Human))
BDBM50245247
PNG
(CHEMBL452082 | N-[(Hydroxyamino)carbonyl]-D-leucyl...)
Show SMILES CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CC(C)C)NC(=O)NO |r|
Show InChI InChI=1S/C17H26N4O4/c1-11(2)9-13(20-17(24)21-25)16(23)19-14(15(22)18-3)10-12-7-5-4-6-8-12/h4-8,11,13-14,25H,9-10H2,1-3H3,(H,18,22)(H,19,23)(H2,20,21,24)/t13-,14+/m1/s1
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n/an/a>3.00E+5n/an/an/an/an/an/a



Università G. d'Annunzio

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MMP7


Eur J Med Chem 43: 1008-14 (2008)


Article DOI: 10.1016/j.ejmech.2007.07.002
BindingDB Entry DOI: 10.7270/Q23T9H1W
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))
BDBM50245247
PNG
(CHEMBL452082 | N-[(Hydroxyamino)carbonyl]-D-leucyl...)
Show SMILES CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CC(C)C)NC(=O)NO |r|
Show InChI InChI=1S/C17H26N4O4/c1-11(2)9-13(20-17(24)21-25)16(23)19-14(15(22)18-3)10-12-7-5-4-6-8-12/h4-8,11,13-14,25H,9-10H2,1-3H3,(H,18,22)(H,19,23)(H2,20,21,24)/t13-,14+/m1/s1
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n/an/a>3.00E+5n/an/an/an/an/an/a



Università G. d'Annunzio

Curated by ChEMBL


Assay Description
Inhibition of human recombinant MMP2


Eur J Med Chem 43: 1008-14 (2008)


Article DOI: 10.1016/j.ejmech.2007.07.002
BindingDB Entry DOI: 10.7270/Q23T9H1W
More data for this
Ligand-Target Pair