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BDBM50400532 CHEMBL2204959

SMILES: CC(C)C[C@H](NC(=O)NCc1cccc2ccccc12)C(=O)NO

InChI Key: InChIKey=RFGJRKGWQKGXJW-INIZCTEOSA-N

Data: 4 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50400532   
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))
BDBM50400532
PNG
(CHEMBL2204959)
Show SMILES CC(C)C[C@H](NC(=O)NCc1cccc2ccccc12)C(=O)NO
Show InChI InChI=1S/C18H23N3O3/c1-12(2)10-16(17(22)21-24)20-18(23)19-11-14-8-5-7-13-6-3-4-9-15(13)14/h3-9,12,16,24H,10-11H2,1-2H3,(H,21,22)(H2,19,20,23)/t16-/m0/s1
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Article
PubMed
n/an/a 50n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of APN in porcine kidney microsome assessed as inhibition of L-Leu-p-nitroanilide substrate hydrolysis incubated for 5 mins before substra...


ACS Med Chem Lett 3: 959-964 (2012)


Article DOI: 10.1021/ml3000758
BindingDB Entry DOI: 10.7270/Q2QJ7JFR
More data for this
Ligand-Target Pair
Aminopeptidase N


(Homo sapiens)
BDBM50400532
PNG
(CHEMBL2204959)
Show SMILES CC(C)C[C@H](NC(=O)NCc1cccc2ccccc12)C(=O)NO
Show InChI InChI=1S/C18H23N3O3/c1-12(2)10-16(17(22)21-24)20-18(23)19-11-14-8-5-7-13-6-3-4-9-15(13)14/h3-9,12,16,24H,10-11H2,1-2H3,(H,21,22)(H2,19,20,23)/t16-/m0/s1
PDB

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Article
PubMed
n/an/a 420n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of APN in human ES2 cell surface assessed as inhibition of L-Leu-p-nitroanilide substrate hydrolysis incubated for 5 mins before substrate...


ACS Med Chem Lett 3: 959-964 (2012)


Article DOI: 10.1021/ml3000758
BindingDB Entry DOI: 10.7270/Q2QJ7JFR
More data for this
Ligand-Target Pair
Collagenase


(homo sapiens (human))
BDBM50400532
PNG
(CHEMBL2204959)
Show SMILES CC(C)C[C@H](NC(=O)NCc1cccc2ccccc12)C(=O)NO
Show InChI InChI=1S/C18H23N3O3/c1-12(2)10-16(17(22)21-24)20-18(23)19-11-14-8-5-7-13-6-3-4-9-15(13)14/h3-9,12,16,24H,10-11H2,1-2H3,(H,21,22)(H2,19,20,23)/t16-/m0/s1
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PubMed
n/an/a 5.45E+5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of recombinant MMP-2 using succinylated gelatin as substrate incubated for 10 mins before addition of substrate measured after 60 mins by ...


ACS Med Chem Lett 3: 959-964 (2012)


Article DOI: 10.1021/ml3000758
BindingDB Entry DOI: 10.7270/Q2QJ7JFR
More data for this
Ligand-Target Pair
Aminopeptidase N


(Mus musculus)
BDBM50400532
PNG
(CHEMBL2204959)
Show SMILES CC(C)C[C@H](NC(=O)NCc1cccc2ccccc12)C(=O)NO
Show InChI InChI=1S/C18H23N3O3/c1-12(2)10-16(17(22)21-24)20-18(23)19-11-14-8-5-7-13-6-3-4-9-15(13)14/h3-9,12,16,24H,10-11H2,1-2H3,(H,21,22)(H2,19,20,23)/t16-/m0/s1
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Article
PubMed
n/an/a 1.82E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of mouse APN


ACS Med Chem Lett 3: 959-964 (2012)


Article DOI: 10.1021/ml3000758
BindingDB Entry DOI: 10.7270/Q2QJ7JFR
More data for this
Ligand-Target Pair