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PubMed code 21911297

Compile data set for download or QSAR
Found 40 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
Aminopeptidase N


(Sus scrofa (Pig))
BDBM23971
PNG
((2S)-2-[(2S,3R)-3-amino-2-hydroxy-4-phenylbutanami...)
Show SMILES CC(C)C[C@H](NC(=O)[C@@H](O)[C@H](N)Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C16H24N2O4/c1-10(2)8-13(16(21)22)18-15(20)14(19)12(17)9-11-6-4-3-5-7-11/h3-7,10,12-14,19H,8-9,17H2,1-2H3,(H,18,20)(H,21,22)/t12-,13+,14+/m1/s1
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n/an/a 5.55E+3n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of pig kidney microsome aminopeptidase N using L-Leu-p-nitroanilide substrate


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Aminopeptidase N


(Sus scrofa (Pig))
BDBM50353911
PNG
(CHEMBL1830651)
Show SMILES ONC(=O)[C@@H](NC(=O)[C@@H]1Cc2ccccc2CN1)c1ccccc1 |r|
Show InChI InChI=1S/C18H19N3O3/c22-17(15-10-13-8-4-5-9-14(13)11-19-15)20-16(18(23)21-24)12-6-2-1-3-7-12/h1-9,15-16,19,24H,10-11H2,(H,20,22)(H,21,23)/t15-,16-/m0/s1
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n/an/a 6.28E+3n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of pig kidney microsome aminopeptidase N using L-Leu-p-nitroanilide substrate


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
Aminopeptidase N


(Sus scrofa (Pig))
BDBM50353915
PNG
(CHEMBL1830654)
Show SMILES CSCC[C@H](NC(=O)[C@@H]1Cc2ccccc2CN1)C(=O)NO |r|
Show InChI InChI=1S/C15H21N3O3S/c1-22-7-6-12(15(20)18-21)17-14(19)13-8-10-4-2-3-5-11(10)9-16-13/h2-5,12-13,16,21H,6-9H2,1H3,(H,17,19)(H,18,20)/t12-,13-/m0/s1
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n/an/a 8.77E+3n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of pig kidney microsome aminopeptidase N using L-Leu-p-nitroanilide substrate


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
Aminopeptidase N


(Sus scrofa (Pig))
BDBM50353914
PNG
(CHEMBL1830653)
Show SMILES ONC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1Cc2ccccc2CN1 |r|
Show InChI InChI=1S/C19H21N3O4/c23-15-7-5-12(6-8-15)9-17(19(25)22-26)21-18(24)16-10-13-3-1-2-4-14(13)11-20-16/h1-8,16-17,20,23,26H,9-11H2,(H,21,24)(H,22,25)/t16-,17-/m0/s1
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n/an/a 9.39E+3n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of pig kidney microsome aminopeptidase N using L-Leu-p-nitroanilide substrate


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
Aminopeptidase N


(Sus scrofa (Pig))
BDBM50353912
PNG
(CHEMBL1830652)
Show SMILES ONC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2ccccc2CN1 |r|
Show InChI InChI=1S/C19H21N3O3/c23-18(16-11-14-8-4-5-9-15(14)12-20-16)21-17(19(24)22-25)10-13-6-2-1-3-7-13/h1-9,16-17,20,25H,10-12H2,(H,21,23)(H,22,24)/t16-,17-/m0/s1
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n/an/a 1.28E+4n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of pig kidney microsome aminopeptidase N using L-Leu-p-nitroanilide substrate


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
Aminopeptidase N


(Sus scrofa (Pig))
BDBM50353921
PNG
(CHEMBL1830659)
Show SMILES ONC(=O)[C@H](CCCNC(=O)OCc1ccccc1)NC(=O)[C@@H]1Cc2ccccc2CN1 |r|
Show InChI InChI=1S/C23H28N4O5/c28-21(20-13-17-9-4-5-10-18(17)14-25-20)26-19(22(29)27-31)11-6-12-24-23(30)32-15-16-7-2-1-3-8-16/h1-5,7-10,19-20,25,31H,6,11-15H2,(H,24,30)(H,26,28)(H,27,29)/t19-,20-/m0/s1
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n/an/a 1.59E+4n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of pig kidney microsome aminopeptidase N using L-Leu-p-nitroanilide substrate


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
Aminopeptidase N


(Sus scrofa (Pig))
BDBM50353904
PNG
(CHEMBL1830508)
Show SMILES ONC(=O)CN1C(=O)CC[C@H](NC(=O)[C@@H]2Cc3ccccc3CN2)C1=O |r|
Show InChI InChI=1S/C17H20N4O5/c22-14(20-26)9-21-15(23)6-5-12(17(21)25)19-16(24)13-7-10-3-1-2-4-11(10)8-18-13/h1-4,12-13,18,26H,5-9H2,(H,19,24)(H,20,22)/t12-,13-/m0/s1
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n/an/a 2.04E+4n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of pig kidney microsome aminopeptidase N using L-Leu-p-nitroanilide substrate


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
Aminopeptidase N


(Sus scrofa (Pig))
BDBM50353907
PNG
(CHEMBL1830511)
Show SMILES ONC(=O)CNC(=O)[C@@H]1Cc2ccccc2CN1 |r|
Show InChI InChI=1S/C12H15N3O3/c16-11(15-18)7-14-12(17)10-5-8-3-1-2-4-9(8)6-13-10/h1-4,10,13,18H,5-7H2,(H,14,17)(H,15,16)/t10-/m0/s1
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n/an/a 2.17E+4n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of pig kidney microsome aminopeptidase N using L-Leu-p-nitroanilide substrate


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
Aminopeptidase N


(Sus scrofa (Pig))
BDBM50353910
PNG
(CHEMBL1830649)
Show SMILES CC(C)C[C@H](NC(=O)[C@@H]1Cc2ccccc2CN1)C(=O)NO |r|
Show InChI InChI=1S/C16H23N3O3/c1-10(2)7-14(16(21)19-22)18-15(20)13-8-11-5-3-4-6-12(11)9-17-13/h3-6,10,13-14,17,22H,7-9H2,1-2H3,(H,18,20)(H,19,21)/t13-,14-/m0/s1
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n/an/a 2.75E+4n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of pig kidney microsome aminopeptidase N using L-Leu-p-nitroanilide substrate


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
Aminopeptidase N


(Homo sapiens (Human))
BDBM23971
PNG
((2S)-2-[(2S,3R)-3-amino-2-hydroxy-4-phenylbutanami...)
Show SMILES CC(C)C[C@H](NC(=O)[C@@H](O)[C@H](N)Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C16H24N2O4/c1-10(2)8-13(16(21)22)18-15(20)14(19)12(17)9-11-6-4-3-5-7-11/h3-7,10,12-14,19H,8-9,17H2,1-2H3,(H,18,20)(H,21,22)/t12-,13+,14+/m1/s1
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n/an/a 2.97E+4n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of aminopeptidase N in human ES2 cells assessed as L-Leu-p-nitroanilide hydrolysis


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Aminopeptidase N


(Homo sapiens (Human))
BDBM50353911
PNG
(CHEMBL1830651)
Show SMILES ONC(=O)[C@@H](NC(=O)[C@@H]1Cc2ccccc2CN1)c1ccccc1 |r|
Show InChI InChI=1S/C18H19N3O3/c22-17(15-10-13-8-4-5-9-14(13)11-19-15)20-16(18(23)21-24)12-6-2-1-3-7-12/h1-9,15-16,19,24H,10-11H2,(H,20,22)(H,21,23)/t15-,16-/m0/s1
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n/an/a 3.27E+4n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of aminopeptidase N in human ES2 cells assessed as L-Leu-p-nitroanilide hydrolysis


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
Aminopeptidase N


(Sus scrofa (Pig))
BDBM50353909
PNG
(CHEMBL1830648)
Show SMILES CC(C)[C@H](NC(=O)[C@@H]1Cc2ccccc2CN1)C(=O)NO |r|
Show InChI InChI=1S/C15H21N3O3/c1-9(2)13(15(20)18-21)17-14(19)12-7-10-5-3-4-6-11(10)8-16-12/h3-6,9,12-13,16,21H,7-8H2,1-2H3,(H,17,19)(H,18,20)/t12-,13-/m0/s1
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n/an/a 3.66E+4n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of pig kidney microsome aminopeptidase N using L-Leu-p-nitroanilide substrate


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
Aminopeptidase N


(Sus scrofa (Pig))
BDBM50353905
PNG
(CHEMBL1830509)
Show SMILES ONC(=O)CCNC(=O)[C@@H]1Cc2ccccc2CN1 |r|
Show InChI InChI=1S/C13H17N3O3/c17-12(16-19)5-6-14-13(18)11-7-9-3-1-2-4-10(9)8-15-11/h1-4,11,15,19H,5-8H2,(H,14,18)(H,16,17)/t11-/m0/s1
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n/an/a 3.71E+4n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of pig kidney microsome aminopeptidase N using L-Leu-p-nitroanilide substrate


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
Aminopeptidase N


(Sus scrofa (Pig))
BDBM50353916
PNG
(CHEMBL1830655)
Show SMILES OC[C@H](NC(=O)[C@@H]1Cc2ccccc2CN1)C(=O)NO |r|
Show InChI InChI=1S/C13H17N3O4/c17-7-11(13(19)16-20)15-12(18)10-5-8-3-1-2-4-9(8)6-14-10/h1-4,10-11,14,17,20H,5-7H2,(H,15,18)(H,16,19)/t10-,11-/m0/s1
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n/an/a 4.02E+4n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of pig kidney microsome aminopeptidase N using L-Leu-p-nitroanilide substrate


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
Aminopeptidase N


(Sus scrofa (Pig))
BDBM50353922
PNG
(CHEMBL1830660)
Show SMILES ONC(=O)[C@H](Cc1cc2ccccc2[nH]1)NC(=O)[C@@H]1Cc2ccccc2CN1 |r|
Show InChI InChI=1S/C21H22N4O3/c26-20(18-10-13-5-1-2-7-15(13)12-22-18)24-19(21(27)25-28)11-16-9-14-6-3-4-8-17(14)23-16/h1-9,18-19,22-23,28H,10-12H2,(H,24,26)(H,25,27)/t18-,19-/m0/s1
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n/an/a 4.34E+4n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of pig kidney microsome aminopeptidase N using L-Leu-p-nitroanilide substrate


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
Aminopeptidase N


(Sus scrofa (Pig))
BDBM50353906
PNG
(CHEMBL1830510)
Show SMILES ONC(=O)CCCNC(=O)[C@@H]1Cc2ccccc2CN1 |r|
Show InChI InChI=1S/C14H19N3O3/c18-13(17-20)6-3-7-15-14(19)12-8-10-4-1-2-5-11(10)9-16-12/h1-2,4-5,12,16,20H,3,6-9H2,(H,15,19)(H,17,18)/t12-/m0/s1
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n/an/a 4.45E+4n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of pig kidney microsome aminopeptidase N using L-Leu-p-nitroanilide substrate


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))
BDBM50353917
PNG
(CHEMBL2369772)
Show SMILES Cl.C[C@@H](O)[C@H](NC(=O)[C@@H]1Cc2ccccc2CN1)C(=O)NO |r|
Show InChI InChI=1S/C14H19N3O4/c1-8(18)12(14(20)17-21)16-13(19)11-6-9-4-2-3-5-10(9)7-15-11/h2-5,8,11-12,15,18,21H,6-7H2,1H3,(H,16,19)(H,17,20)/t8?,11-,12-/m0/s1
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n/an/a 4.65E+4n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of MMP2 after 30 mins


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
Aminopeptidase N


(Sus scrofa (Pig))
BDBM50353917
PNG
(CHEMBL2369772)
Show SMILES Cl.C[C@@H](O)[C@H](NC(=O)[C@@H]1Cc2ccccc2CN1)C(=O)NO |r|
Show InChI InChI=1S/C14H19N3O4/c1-8(18)12(14(20)17-21)16-13(19)11-6-9-4-2-3-5-10(9)7-15-11/h2-5,8,11-12,15,18,21H,6-7H2,1H3,(H,16,19)(H,17,20)/t8?,11-,12-/m0/s1
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n/an/a 4.66E+4n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of pig kidney microsome aminopeptidase N using L-Leu-p-nitroanilide substrate


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
Aminopeptidase N


(Sus scrofa (Pig))
BDBM50353908
PNG
(CHEMBL1830512)
Show SMILES C[C@H](NC(=O)[C@@H]1Cc2ccccc2CN1)C(=O)NO |r|
Show InChI InChI=1S/C13H17N3O3/c1-8(12(17)16-19)15-13(18)11-6-9-4-2-3-5-10(9)7-14-11/h2-5,8,11,14,19H,6-7H2,1H3,(H,15,18)(H,16,17)/t8-,11-/m0/s1
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n/an/a 8.39E+4n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of pig kidney microsome aminopeptidase N using L-Leu-p-nitroanilide substrate


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
Aminopeptidase N


(Sus scrofa (Pig))
BDBM50353918
PNG
(CHEMBL1830657)
Show SMILES ONC(=O)[C@@H]1CCCN1C(=O)[C@@H]1Cc2ccccc2CN1 |r|
Show InChI InChI=1S/C15H19N3O3/c19-14(17-21)13-6-3-7-18(13)15(20)12-8-10-4-1-2-5-11(10)9-16-12/h1-2,4-5,12-13,16,21H,3,6-9H2,(H,17,19)/t12-,13-/m0/s1
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n/an/a 1.04E+5n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of pig kidney microsome aminopeptidase N using L-Leu-p-nitroanilide substrate


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))
BDBM50353918
PNG
(CHEMBL1830657)
Show SMILES ONC(=O)[C@@H]1CCCN1C(=O)[C@@H]1Cc2ccccc2CN1 |r|
Show InChI InChI=1S/C15H19N3O3/c19-14(17-21)13-6-3-7-18(13)15(20)12-8-10-4-1-2-5-11(10)9-16-12/h1-2,4-5,12-13,16,21H,3,6-9H2,(H,17,19)/t12-,13-/m0/s1
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n/an/a 1.57E+5n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of MMP2 after 30 mins


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))
BDBM23971
PNG
((2S)-2-[(2S,3R)-3-amino-2-hydroxy-4-phenylbutanami...)
Show SMILES CC(C)C[C@H](NC(=O)[C@@H](O)[C@H](N)Cc1ccccc1)C(O)=O
Show InChI InChI=1S/C16H24N2O4/c1-10(2)8-13(16(21)22)18-15(20)14(19)12(17)9-11-6-4-3-5-7-11/h3-7,10,12-14,19H,8-9,17H2,1-2H3,(H,18,20)(H,21,22)/t12-,13+,14+/m1/s1
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n/an/a 1.63E+5n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of MMP2 after 30 mins


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))
BDBM50353915
PNG
(CHEMBL1830654)
Show SMILES CSCC[C@H](NC(=O)[C@@H]1Cc2ccccc2CN1)C(=O)NO |r|
Show InChI InChI=1S/C15H21N3O3S/c1-22-7-6-12(15(20)18-21)17-14(19)13-8-10-4-2-3-5-11(10)9-16-13/h2-5,12-13,16,21H,6-9H2,1H3,(H,17,19)(H,18,20)/t12-,13-/m0/s1
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n/an/a 1.66E+5n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of MMP2 after 30 mins


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))
BDBM50353907
PNG
(CHEMBL1830511)
Show SMILES ONC(=O)CNC(=O)[C@@H]1Cc2ccccc2CN1 |r|
Show InChI InChI=1S/C12H15N3O3/c16-11(15-18)7-14-12(17)10-5-8-3-1-2-4-9(8)6-13-10/h1-4,10,13,18H,5-7H2,(H,14,17)(H,15,16)/t10-/m0/s1
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n/an/a 2.49E+5n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of MMP2 after 30 mins


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))
BDBM50353906
PNG
(CHEMBL1830510)
Show SMILES ONC(=O)CCCNC(=O)[C@@H]1Cc2ccccc2CN1 |r|
Show InChI InChI=1S/C14H19N3O3/c18-13(17-20)6-3-7-15-14(19)12-8-10-4-1-2-5-11(10)9-16-12/h1-2,4-5,12,16,20H,3,6-9H2,(H,15,19)(H,17,18)/t12-/m0/s1
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n/an/a 2.52E+5n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of MMP2 after 30 mins


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))
BDBM50353916
PNG
(CHEMBL1830655)
Show SMILES OC[C@H](NC(=O)[C@@H]1Cc2ccccc2CN1)C(=O)NO |r|
Show InChI InChI=1S/C13H17N3O4/c17-7-11(13(19)16-20)15-12(18)10-5-8-3-1-2-4-9(8)6-14-10/h1-4,10-11,14,17,20H,5-7H2,(H,15,18)(H,16,19)/t10-,11-/m0/s1
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n/an/a 2.68E+5n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of MMP2 after 30 mins


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))
BDBM50353919
PNG
(CHEMBL1830658)
Show SMILES ONC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H]1Cc2ccccc2CN1 |r|
Show InChI InChI=1S/C15H19N3O4/c19-11-6-13(14(20)17-22)18(8-11)15(21)12-5-9-3-1-2-4-10(9)7-16-12/h1-4,11-13,16,19,22H,5-8H2,(H,17,20)/t11-,12+,13+/m1/s1
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n/an/a 2.76E+5n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of MMP2 after 30 mins


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))
BDBM50353909
PNG
(CHEMBL1830648)
Show SMILES CC(C)[C@H](NC(=O)[C@@H]1Cc2ccccc2CN1)C(=O)NO |r|
Show InChI InChI=1S/C15H21N3O3/c1-9(2)13(15(20)18-21)17-14(19)12-7-10-5-3-4-6-11(10)8-16-12/h3-6,9,12-13,16,21H,7-8H2,1-2H3,(H,17,19)(H,18,20)/t12-,13-/m0/s1
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n/an/a 3.07E+5n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of MMP2 after 30 mins


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))
BDBM50353911
PNG
(CHEMBL1830651)
Show SMILES ONC(=O)[C@@H](NC(=O)[C@@H]1Cc2ccccc2CN1)c1ccccc1 |r|
Show InChI InChI=1S/C18H19N3O3/c22-17(15-10-13-8-4-5-9-14(13)11-19-15)20-16(18(23)21-24)12-6-2-1-3-7-12/h1-9,15-16,19,24H,10-11H2,(H,20,22)(H,21,23)/t15-,16-/m0/s1
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n/an/a 3.93E+5n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of MMP2 after 30 mins


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
Aminopeptidase N


(Sus scrofa (Pig))
BDBM50353925
PNG
(CHEMBL1830664)
Show SMILES ONC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2ccccc2CN1 |r|
Show InChI InChI=1S/C28H30N4O4/c33-26(23-17-21-13-7-8-14-22(21)18-29-23)30-24(15-19-9-3-1-4-10-19)27(34)31-25(28(35)32-36)16-20-11-5-2-6-12-20/h1-14,23-25,29,36H,15-18H2,(H,30,33)(H,31,34)(H,32,35)/t23-,24-,25-/m0/s1
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n/an/a 4.35E+5n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of pig kidney microsome aminopeptidase N using L-Leu-p-nitroanilide substrate


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))
BDBM50353908
PNG
(CHEMBL1830512)
Show SMILES C[C@H](NC(=O)[C@@H]1Cc2ccccc2CN1)C(=O)NO |r|
Show InChI InChI=1S/C13H17N3O3/c1-8(12(17)16-19)15-13(18)11-6-9-4-2-3-5-10(9)7-14-11/h2-5,8,11,14,19H,6-7H2,1H3,(H,15,18)(H,16,17)/t8-,11-/m0/s1
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n/an/a 4.63E+5n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of MMP2 after 30 mins


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
Aminopeptidase N


(Sus scrofa (Pig))
BDBM50353920
PNG
(CHEMBL1830662)
Show SMILES CC(C)C[C@H](NC(=O)[C@@H]1Cc2ccccc2CN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NO |r|
Show InChI InChI=1S/C25H32N4O4/c1-16(2)12-21(27-23(30)20-14-18-10-6-7-11-19(18)15-26-20)24(31)28-22(25(32)29-33)13-17-8-4-3-5-9-17/h3-11,16,20-22,26,33H,12-15H2,1-2H3,(H,27,30)(H,28,31)(H,29,32)/t20-,21-,22-/m0/s1
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n/an/a 4.65E+5n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of pig kidney microsome aminopeptidase N using L-Leu-p-nitroanilide substrate


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
Aminopeptidase N


(Sus scrofa (Pig))
BDBM50353923
PNG
(CHEMBL1830661)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1Cc2ccccc2CN1)C(=O)NO |r|
Show InChI InChI=1S/C22H34N4O4/c1-13(2)9-18(21(28)25-19(10-14(3)4)22(29)26-30)24-20(27)17-11-15-7-5-6-8-16(15)12-23-17/h5-8,13-14,17-19,23,30H,9-12H2,1-4H3,(H,24,27)(H,25,28)(H,26,29)/t17-,18-,19-/m0/s1
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n/an/a 4.81E+5n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of pig kidney microsome aminopeptidase N using L-Leu-p-nitroanilide substrate


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))
BDBM50353905
PNG
(CHEMBL1830509)
Show SMILES ONC(=O)CCNC(=O)[C@@H]1Cc2ccccc2CN1 |r|
Show InChI InChI=1S/C13H17N3O3/c17-12(16-19)5-6-14-13(18)11-7-9-3-1-2-4-10(9)8-15-11/h1-4,11,15,19H,5-8H2,(H,14,18)(H,16,17)/t11-/m0/s1
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n/an/a 5.17E+5n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of MMP2 after 30 mins


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))
BDBM50353914
PNG
(CHEMBL1830653)
Show SMILES ONC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1Cc2ccccc2CN1 |r|
Show InChI InChI=1S/C19H21N3O4/c23-15-7-5-12(6-8-15)9-17(19(25)22-26)21-18(24)16-10-13-3-1-2-4-14(13)11-20-16/h1-8,16-17,20,23,26H,9-11H2,(H,21,24)(H,22,25)/t16-,17-/m0/s1
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n/an/a 5.40E+5n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of MMP2 after 30 mins


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
Aminopeptidase N


(Sus scrofa (Pig))
BDBM50353924
PNG
(CHEMBL1830663)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2ccccc2CN1)C(=O)NO |r|
Show InChI InChI=1S/C25H32N4O4/c1-16(2)12-21(25(32)29-33)27-24(31)22(13-17-8-4-3-5-9-17)28-23(30)20-14-18-10-6-7-11-19(18)15-26-20/h3-11,16,20-22,26,33H,12-15H2,1-2H3,(H,27,31)(H,28,30)(H,29,32)/t20-,21-,22-/m0/s1
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n/an/a 5.55E+5n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of pig kidney microsome aminopeptidase N using L-Leu-p-nitroanilide substrate


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))
BDBM50353920
PNG
(CHEMBL1830662)
Show SMILES CC(C)C[C@H](NC(=O)[C@@H]1Cc2ccccc2CN1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NO |r|
Show InChI InChI=1S/C25H32N4O4/c1-16(2)12-21(27-23(30)20-14-18-10-6-7-11-19(18)15-26-20)24(31)28-22(25(32)29-33)13-17-8-4-3-5-9-17/h3-11,16,20-22,26,33H,12-15H2,1-2H3,(H,27,30)(H,28,31)(H,29,32)/t20-,21-,22-/m0/s1
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n/an/a 6.57E+5n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of MMP2 after 30 mins


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))
BDBM50353913
PNG
(CHEMBL2369771)
Show SMILES Cl.CC[C@H](C)[C@H](NC(=O)[C@@H]1Cc2ccccc2CN1)C(=O)NO |r|
Show InChI InChI=1S/C16H23N3O3/c1-3-10(2)14(16(21)19-22)18-15(20)13-8-11-6-4-5-7-12(11)9-17-13/h4-7,10,13-14,17,22H,3,8-9H2,1-2H3,(H,18,20)(H,19,21)/t10?,13-,14-/m0/s1
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n/an/a 6.72E+5n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of MMP2 after 30 mins


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))
BDBM50353910
PNG
(CHEMBL1830649)
Show SMILES CC(C)C[C@H](NC(=O)[C@@H]1Cc2ccccc2CN1)C(=O)NO |r|
Show InChI InChI=1S/C16H23N3O3/c1-10(2)7-14(16(21)19-22)18-15(20)13-8-11-5-3-4-6-12(11)9-17-13/h3-6,10,13-14,17,22H,7-9H2,1-2H3,(H,18,20)(H,19,21)/t13-,14-/m0/s1
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n/an/a 8.36E+5n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of MMP2 after 30 mins


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
72 kDa type IV collagenase


(Homo sapiens (Human))
BDBM50353912
PNG
(CHEMBL1830652)
Show SMILES ONC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1Cc2ccccc2CN1 |r|
Show InChI InChI=1S/C19H21N3O3/c23-18(16-11-14-8-4-5-9-15(14)12-20-16)21-17(19(24)22-25)10-13-6-2-1-3-7-13/h1-9,16-17,20,25H,10-12H2,(H,21,23)(H,22,24)/t16-,17-/m0/s1
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Article
PubMed
n/an/a 9.40E+5n/an/an/an/an/an/a



Shan Dong University

Curated by ChEMBL


Assay Description
Inhibition of MMP2 after 30 mins


Bioorg Med Chem 19: 6015-25 (2011)


Article DOI: 10.1016/j.bmc.2011.08.041
BindingDB Entry DOI: 10.7270/Q2251JKK
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%