Found 77 hits of Enzyme Inhibition Constant Data Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50123932
(CHEMBL3622226)Show SMILES Cc1ccc(C2=NN(C(C2)c2cccc3ccccc23)c2ccc(cc2)S(N)(=O)=O)c(C)c1 |t:5| Show InChI InChI=1S/C27H25N3O2S/c1-18-10-15-23(19(2)16-18)26-17-27(25-9-5-7-20-6-3-4-8-24(20)25)30(29-26)21-11-13-22(14-12-21)33(28,31)32/h3-16,27H,17H2,1-2H3,(H2,28,31,32) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 209 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50123932
(CHEMBL3622226)Show SMILES Cc1ccc(C2=NN(C(C2)c2cccc3ccccc23)c2ccc(cc2)S(N)(=O)=O)c(C)c1 |t:5| Show InChI InChI=1S/C27H25N3O2S/c1-18-10-15-23(19(2)16-18)26-17-27(25-9-5-7-20-6-3-4-8-24(20)25)30(29-26)21-11-13-22(14-12-21)33(28,31)32/h3-16,27H,17H2,1-2H3,(H2,28,31,32) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 210 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50123934
(CHEMBL3622785)Show SMILES CCOc1ccc(cc1)C1=NN(C(C1)c1cccc2ccccc12)c1ccc(cc1)S(N)(=O)=O |t:10| Show InChI InChI=1S/C27H25N3O3S/c1-2-33-22-14-10-20(11-15-22)26-18-27(25-9-5-7-19-6-3-4-8-24(19)25)30(29-26)21-12-16-23(17-13-21)34(28,31)32/h3-17,27H,2,18H2,1H3,(H2,28,31,32) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 794 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50123934
(CHEMBL3622785)Show SMILES CCOc1ccc(cc1)C1=NN(C(C1)c1cccc2ccccc12)c1ccc(cc1)S(N)(=O)=O |t:10| Show InChI InChI=1S/C27H25N3O3S/c1-2-33-22-14-10-20(11-15-22)26-18-27(25-9-5-7-19-6-3-4-8-24(19)25)30(29-26)21-12-16-23(17-13-21)34(28,31)32/h3-17,27H,2,18H2,1H3,(H2,28,31,32) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 810 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124122
(CHEMBL3622800)Show SMILES [H][C@]12CC(O)=C(C(N)=O)C(=O)[C@@]1(O)C(O)=C1C(=O)c3c(O)cccc3[C@@](C)(O)[C@@]1([H])C2 |r,t:4,15| Show InChI InChI=1S/C20H19NO8/c1-19(28)8-3-2-4-10(22)12(8)15(24)13-9(19)5-7-6-11(23)14(18(21)27)17(26)20(7,29)16(13)25/h2-4,7,9,22-23,25,28-29H,5-6H2,1H3,(H2,21,27)/t7-,9-,19+,20-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.26E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50123932
(CHEMBL3622226)Show SMILES Cc1ccc(C2=NN(C(C2)c2cccc3ccccc23)c2ccc(cc2)S(N)(=O)=O)c(C)c1 |t:5| Show InChI InChI=1S/C27H25N3O2S/c1-18-10-15-23(19(2)16-18)26-17-27(25-9-5-7-20-6-3-4-8-24(20)25)30(29-26)21-11-13-22(14-12-21)33(28,31)32/h3-16,27H,17H2,1-2H3,(H2,28,31,32) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.87E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP9 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50123984
(CHEMBL3622791)Show SMILES COc1cccc(c1)C1=NN(C(C1)c1ccc2ccccc2c1)c1ccc(cc1)S(N)(=O)=O |t:9| Show InChI InChI=1S/C26H23N3O3S/c1-32-23-8-4-7-20(16-23)25-17-26(21-10-9-18-5-2-3-6-19(18)15-21)29(28-25)22-11-13-24(14-12-22)33(27,30)31/h2-16,26H,17H2,1H3,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.15E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50123984
(CHEMBL3622791)Show SMILES COc1cccc(c1)C1=NN(C(C1)c1ccc2ccccc2c1)c1ccc(cc1)S(N)(=O)=O |t:9| Show InChI InChI=1S/C26H23N3O3S/c1-32-23-8-4-7-20(16-23)25-17-26(21-10-9-18-5-2-3-6-19(18)15-21)29(28-25)22-11-13-24(14-12-22)33(27,30)31/h2-16,26H,17H2,1H3,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.15E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50124122
(CHEMBL3622800)Show SMILES [H][C@]12CC(O)=C(C(N)=O)C(=O)[C@@]1(O)C(O)=C1C(=O)c3c(O)cccc3[C@@](C)(O)[C@@]1([H])C2 |r,t:4,15| Show InChI InChI=1S/C20H19NO8/c1-19(28)8-3-2-4-10(22)12(8)15(24)13-9(19)5-7-6-11(23)14(18(21)27)17(26)20(7,29)16(13)25/h2-4,7,9,22-23,25,28-29H,5-6H2,1H3,(H2,21,27)/t7-,9-,19+,20-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.52E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP9 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50123979
(CHEMBL3622786)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1cccc2ccccc12)c1ccc(Cl)cc1 |c:12| Show InChI InChI=1S/C25H20ClN3O2S/c26-19-10-8-18(9-11-19)24-16-25(23-7-3-5-17-4-1-2-6-22(17)23)29(28-24)20-12-14-21(15-13-20)32(27,30)31/h1-15,25H,16H2,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.69E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50123979
(CHEMBL3622786)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1cccc2ccccc12)c1ccc(Cl)cc1 |c:12| Show InChI InChI=1S/C25H20ClN3O2S/c26-19-10-8-18(9-11-19)24-16-25(23-7-3-5-17-4-1-2-6-22(17)23)29(28-24)20-12-14-21(15-13-20)32(27,30)31/h1-15,25H,16H2,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124100
(CHEMBL3622795)Show SMILES Cc1ccc(cc1)C1=NN(C(C1)c1ccc2ccccc2c1)c1ccc(cc1)S(N)(=O)=O |t:8| Show InChI InChI=1S/C26H23N3O2S/c1-18-6-8-20(9-7-18)25-17-26(22-11-10-19-4-2-3-5-21(19)16-22)29(28-25)23-12-14-24(15-13-23)32(27,30)31/h2-16,26H,17H2,1H3,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.81E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124100
(CHEMBL3622795)Show SMILES Cc1ccc(cc1)C1=NN(C(C1)c1ccc2ccccc2c1)c1ccc(cc1)S(N)(=O)=O |t:8| Show InChI InChI=1S/C26H23N3O2S/c1-18-6-8-20(9-7-18)25-17-26(22-11-10-19-4-2-3-5-21(19)16-22)29(28-25)23-12-14-24(15-13-23)32(27,30)31/h2-16,26H,17H2,1H3,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.82E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124124
(CHEMBL3622220)Show SMILES Cc1ccccc1C1=NN(C(C1)c1cccc2ccccc12)c1ccc(cc1)S(N)(=O)=O |t:8| Show InChI InChI=1S/C26H23N3O2S/c1-18-7-2-4-10-22(18)25-17-26(24-12-6-9-19-8-3-5-11-23(19)24)29(28-25)20-13-15-21(16-14-20)32(27,30)31/h2-16,26H,17H2,1H3,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.88E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124124
(CHEMBL3622220)Show SMILES Cc1ccccc1C1=NN(C(C1)c1cccc2ccccc12)c1ccc(cc1)S(N)(=O)=O |t:8| Show InChI InChI=1S/C26H23N3O2S/c1-18-7-2-4-10-22(18)25-17-26(24-12-6-9-19-8-3-5-11-23(19)24)29(28-25)20-13-15-21(16-14-20)32(27,30)31/h2-16,26H,17H2,1H3,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.91E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50123934
(CHEMBL3622785)Show SMILES CCOc1ccc(cc1)C1=NN(C(C1)c1cccc2ccccc12)c1ccc(cc1)S(N)(=O)=O |t:10| Show InChI InChI=1S/C27H25N3O3S/c1-2-33-22-14-10-20(11-15-22)26-18-27(25-9-5-7-19-6-3-4-8-24(19)25)30(29-26)21-12-16-23(17-13-21)34(28,31)32/h3-17,27H,2,18H2,1H3,(H2,28,31,32) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.19E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP9 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124126
(CHEMBL3622221)Show SMILES Cc1cccc(c1)C1=NN(C(C1)c1cccc2ccccc12)c1ccc(cc1)S(N)(=O)=O |t:8| Show InChI InChI=1S/C26H23N3O2S/c1-18-6-4-9-20(16-18)25-17-26(24-11-5-8-19-7-2-3-10-23(19)24)29(28-25)21-12-14-22(15-13-21)32(27,30)31/h2-16,26H,17H2,1H3,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.24E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124126
(CHEMBL3622221)Show SMILES Cc1cccc(c1)C1=NN(C(C1)c1cccc2ccccc12)c1ccc(cc1)S(N)(=O)=O |t:8| Show InChI InChI=1S/C26H23N3O2S/c1-18-6-4-9-20(16-18)25-17-26(24-11-5-8-19-7-2-3-10-23(19)24)29(28-25)21-12-14-22(15-13-21)32(27,30)31/h2-16,26H,17H2,1H3,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.24E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124104
(CHEMBL3622799)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1ccc2ccccc2c1)c1ccc(Cl)cc1 |c:12| Show InChI InChI=1S/C25H20ClN3O2S/c26-21-9-7-18(8-10-21)24-16-25(20-6-5-17-3-1-2-4-19(17)15-20)29(28-24)22-11-13-23(14-12-22)32(27,30)31/h1-15,25H,16H2,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124104
(CHEMBL3622799)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1ccc2ccccc2c1)c1ccc(Cl)cc1 |c:12| Show InChI InChI=1S/C25H20ClN3O2S/c26-21-9-7-18(8-10-21)24-16-25(20-6-5-17-3-1-2-4-19(17)15-20)29(28-24)22-11-13-23(14-12-22)32(27,30)31/h1-15,25H,16H2,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.63E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50123983
(CHEMBL3622790)Show SMILES Cc1cccc(c1)C1=NN(C(C1)c1ccc2ccccc2c1)c1ccc(cc1)S(N)(=O)=O |t:8| Show InChI InChI=1S/C26H23N3O2S/c1-18-5-4-8-21(15-18)25-17-26(22-10-9-19-6-2-3-7-20(19)16-22)29(28-25)23-11-13-24(14-12-23)32(27,30)31/h2-16,26H,17H2,1H3,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.86E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50123983
(CHEMBL3622790)Show SMILES Cc1cccc(c1)C1=NN(C(C1)c1ccc2ccccc2c1)c1ccc(cc1)S(N)(=O)=O |t:8| Show InChI InChI=1S/C26H23N3O2S/c1-18-5-4-8-21(15-18)25-17-26(22-10-9-19-6-2-3-7-20(19)16-22)29(28-25)23-11-13-24(14-12-23)32(27,30)31/h2-16,26H,17H2,1H3,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.86E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50123933
(CHEMBL3622784)Show SMILES COc1ccc(cc1)C1=NN(C(C1)c1cccc2ccccc12)c1ccc(cc1)S(N)(=O)=O |t:9| Show InChI InChI=1S/C26H23N3O3S/c1-32-21-13-9-19(10-14-21)25-17-26(24-8-4-6-18-5-2-3-7-23(18)24)29(28-25)20-11-15-22(16-12-20)33(27,30)31/h2-16,26H,17H2,1H3,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.17E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50123933
(CHEMBL3622784)Show SMILES COc1ccc(cc1)C1=NN(C(C1)c1cccc2ccccc12)c1ccc(cc1)S(N)(=O)=O |t:9| Show InChI InChI=1S/C26H23N3O3S/c1-32-21-13-9-19(10-14-21)25-17-26(24-8-4-6-18-5-2-3-7-23(18)24)29(28-25)20-11-15-22(16-12-20)33(27,30)31/h2-16,26H,17H2,1H3,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.27E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50124126
(CHEMBL3622221)Show SMILES Cc1cccc(c1)C1=NN(C(C1)c1cccc2ccccc12)c1ccc(cc1)S(N)(=O)=O |t:8| Show InChI InChI=1S/C26H23N3O2S/c1-18-6-4-9-20(16-18)25-17-26(24-11-5-8-19-7-2-3-10-23(19)24)29(28-25)21-12-14-22(15-13-21)32(27,30)31/h2-16,26H,17H2,1H3,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.29E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP9 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50123984
(CHEMBL3622791)Show SMILES COc1cccc(c1)C1=NN(C(C1)c1ccc2ccccc2c1)c1ccc(cc1)S(N)(=O)=O |t:9| Show InChI InChI=1S/C26H23N3O3S/c1-32-23-8-4-7-20(16-23)25-17-26(21-10-9-18-5-2-3-6-19(18)15-21)29(28-25)22-11-13-24(14-12-22)33(27,30)31/h2-16,26H,17H2,1H3,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 4.68E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP9 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124127
(CHEMBL3622222)Show SMILES COc1cccc(c1)C1=NN(C(C1)c1cccc2ccccc12)c1ccc(cc1)S(N)(=O)=O |t:9| Show InChI InChI=1S/C26H23N3O3S/c1-32-21-9-4-8-19(16-21)25-17-26(24-11-5-7-18-6-2-3-10-23(18)24)29(28-25)20-12-14-22(15-13-20)33(27,30)31/h2-16,26H,17H2,1H3,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.79E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124127
(CHEMBL3622222)Show SMILES COc1cccc(c1)C1=NN(C(C1)c1cccc2ccccc12)c1ccc(cc1)S(N)(=O)=O |t:9| Show InChI InChI=1S/C26H23N3O3S/c1-32-21-9-4-8-19(16-21)25-17-26(24-11-5-7-18-6-2-3-10-23(18)24)29(28-25)20-12-14-22(15-13-20)33(27,30)31/h2-16,26H,17H2,1H3,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.83E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50124100
(CHEMBL3622795)Show SMILES Cc1ccc(cc1)C1=NN(C(C1)c1ccc2ccccc2c1)c1ccc(cc1)S(N)(=O)=O |t:8| Show InChI InChI=1S/C26H23N3O2S/c1-18-6-8-20(9-7-18)25-17-26(22-11-10-19-4-2-3-5-21(19)16-22)29(28-25)23-12-14-24(15-13-23)32(27,30)31/h2-16,26H,17H2,1H3,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.95E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP9 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50124124
(CHEMBL3622220)Show SMILES Cc1ccccc1C1=NN(C(C1)c1cccc2ccccc12)c1ccc(cc1)S(N)(=O)=O |t:8| Show InChI InChI=1S/C26H23N3O2S/c1-18-7-2-4-10-22(18)25-17-26(24-12-6-9-19-8-3-5-11-23(19)24)29(28-25)20-13-15-21(16-14-20)32(27,30)31/h2-16,26H,17H2,1H3,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.43E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP9 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50123979
(CHEMBL3622786)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1cccc2ccccc12)c1ccc(Cl)cc1 |c:12| Show InChI InChI=1S/C25H20ClN3O2S/c26-19-10-8-18(9-11-19)24-16-25(23-7-3-5-17-4-1-2-6-22(17)23)29(28-24)20-12-14-21(15-13-20)32(27,30)31/h1-15,25H,16H2,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.47E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP9 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50124104
(CHEMBL3622799)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1ccc2ccccc2c1)c1ccc(Cl)cc1 |c:12| Show InChI InChI=1S/C25H20ClN3O2S/c26-21-9-7-18(8-10-21)24-16-25(20-6-5-17-3-1-2-4-19(17)15-20)29(28-24)22-11-13-23(14-12-22)32(27,30)31/h1-15,25H,16H2,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.88E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP9 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50123983
(CHEMBL3622790)Show SMILES Cc1cccc(c1)C1=NN(C(C1)c1ccc2ccccc2c1)c1ccc(cc1)S(N)(=O)=O |t:8| Show InChI InChI=1S/C26H23N3O2S/c1-18-5-4-8-21(15-18)25-17-26(22-10-9-19-6-2-3-7-20(19)16-22)29(28-25)23-11-13-24(14-12-23)32(27,30)31/h2-16,26H,17H2,1H3,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.92E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP9 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50124011
(CHEMBL3622792)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1ccc2ccccc2c1)c1cccc(F)c1 |c:12| Show InChI InChI=1S/C25H20FN3O2S/c26-21-7-3-6-19(15-21)24-16-25(20-9-8-17-4-1-2-5-18(17)14-20)29(28-24)22-10-12-23(13-11-22)32(27,30)31/h1-15,25H,16H2,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.96E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP9 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50124127
(CHEMBL3622222)Show SMILES COc1cccc(c1)C1=NN(C(C1)c1cccc2ccccc12)c1ccc(cc1)S(N)(=O)=O |t:9| Show InChI InChI=1S/C26H23N3O3S/c1-32-21-9-4-8-19(16-21)25-17-26(24-11-5-7-18-6-2-3-10-23(18)24)29(28-25)20-12-14-22(15-13-20)33(27,30)31/h2-16,26H,17H2,1H3,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.72E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP9 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124130
(CHEMBL3622225)Show SMILES Cc1ccc(cc1)C1=NN(C(C1)c1cccc2ccccc12)c1ccc(cc1)S(N)(=O)=O |t:8| Show InChI InChI=1S/C26H23N3O2S/c1-18-9-11-20(12-10-18)25-17-26(24-8-4-6-19-5-2-3-7-23(19)24)29(28-25)21-13-15-22(16-14-21)32(27,30)31/h2-16,26H,17H2,1H3,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.76E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124130
(CHEMBL3622225)Show SMILES Cc1ccc(cc1)C1=NN(C(C1)c1cccc2ccccc12)c1ccc(cc1)S(N)(=O)=O |t:8| Show InChI InChI=1S/C26H23N3O2S/c1-18-9-11-20(12-10-18)25-17-26(24-8-4-6-19-5-2-3-7-23(19)24)29(28-25)21-13-15-22(16-14-21)32(27,30)31/h2-16,26H,17H2,1H3,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.81E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50124099
(CHEMBL3622794)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1ccc2ccccc2c1)c1cccc(I)c1 |c:12| Show InChI InChI=1S/C25H20IN3O2S/c26-21-7-3-6-19(15-21)24-16-25(20-9-8-17-4-1-2-5-18(17)14-20)29(28-24)22-10-12-23(13-11-22)32(27,30)31/h1-15,25H,16H2,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 6.91E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP9 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50123981
(CHEMBL3622788)Show SMILES Cc1ccccc1C1=NN(C(C1)c1ccc2ccccc2c1)c1ccc(cc1)S(N)(=O)=O |t:8| Show InChI InChI=1S/C26H23N3O2S/c1-18-6-2-5-9-24(18)25-17-26(21-11-10-19-7-3-4-8-20(19)16-21)29(28-25)22-12-14-23(15-13-22)32(27,30)31/h2-16,26H,17H2,1H3,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.91E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP9 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124123
(CHEMBL3622219)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1cccc2ccccc12)c1ccccc1 |c:12| Show InChI InChI=1S/C25H21N3O2S/c26-31(29,30)21-15-13-20(14-16-21)28-25(17-24(27-28)19-8-2-1-3-9-19)23-12-6-10-18-7-4-5-11-22(18)23/h1-16,25H,17H2,(H2,26,29,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.92E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124123
(CHEMBL3622219)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1cccc2ccccc12)c1ccccc1 |c:12| Show InChI InChI=1S/C25H21N3O2S/c26-31(29,30)21-15-13-20(14-16-21)28-25(17-24(27-28)19-8-2-1-3-9-19)23-12-6-10-18-7-4-5-11-22(18)23/h1-16,25H,17H2,(H2,26,29,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.94E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50124128
(CHEMBL3622223)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1cccc2ccccc12)c1cccc(Br)c1 |c:12| Show InChI InChI=1S/C25H20BrN3O2S/c26-19-8-3-7-18(15-19)24-16-25(23-10-4-6-17-5-1-2-9-22(17)23)29(28-24)20-11-13-21(14-12-20)32(27,30)31/h1-15,25H,16H2,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.97E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP9 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124125
(CHEMBL3621216)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1cccc2ccccc12)c1ccccc1Cl |c:12| Show InChI InChI=1S/C25H20ClN3O2S/c26-23-11-4-3-9-22(23)24-16-25(21-10-5-7-17-6-1-2-8-20(17)21)29(28-24)18-12-14-19(15-13-18)32(27,30)31/h1-15,25H,16H2,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8.51E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50123933
(CHEMBL3622784)Show SMILES COc1ccc(cc1)C1=NN(C(C1)c1cccc2ccccc12)c1ccc(cc1)S(N)(=O)=O |t:9| Show InChI InChI=1S/C26H23N3O3S/c1-32-21-13-9-19(10-14-21)25-17-26(24-8-4-6-18-5-2-3-7-23(18)24)29(28-25)20-11-15-22(16-12-20)33(27,30)31/h2-16,26H,17H2,1H3,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8.61E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP9 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124125
(CHEMBL3621216)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1cccc2ccccc12)c1ccccc1Cl |c:12| Show InChI InChI=1S/C25H20ClN3O2S/c26-23-11-4-3-9-22(23)24-16-25(21-10-5-7-17-6-1-2-8-20(17)21)29(28-24)18-12-14-19(15-13-18)32(27,30)31/h1-15,25H,16H2,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 8.63E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50123982
(CHEMBL3622789)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1ccc2ccccc2c1)c1ccccc1Cl |c:12| Show InChI InChI=1S/C25H20ClN3O2S/c26-23-8-4-3-7-22(23)24-16-25(19-10-9-17-5-1-2-6-18(17)15-19)29(28-24)20-11-13-21(14-12-20)32(27,30)31/h1-15,25H,16H2,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 8.72E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP9 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124129
(CHEMBL3622224)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1cccc2ccccc12)c1cccc(I)c1 |c:12| Show InChI InChI=1S/C25H20IN3O2S/c26-19-8-3-7-18(15-19)24-16-25(23-10-4-6-17-5-1-2-9-22(17)23)29(28-24)20-11-13-21(14-12-20)32(27,30)31/h1-15,25H,16H2,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9.33E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124129
(CHEMBL3622224)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1cccc2ccccc12)c1cccc(I)c1 |c:12| Show InChI InChI=1S/C25H20IN3O2S/c26-19-8-3-7-18(15-19)24-16-25(23-10-4-6-17-5-1-2-9-22(17)23)29(28-24)20-11-13-21(14-12-20)32(27,30)31/h1-15,25H,16H2,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9.43E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124101
(CHEMBL3622796)Show SMILES COc1ccc(cc1)C1=NN(C(C1)c1ccc2ccccc2c1)c1ccc(cc1)S(N)(=O)=O |t:9| Show InChI InChI=1S/C26H23N3O3S/c1-32-23-12-8-19(9-13-23)25-17-26(21-7-6-18-4-2-3-5-20(18)16-21)29(28-25)22-10-14-24(15-11-22)33(27,30)31/h2-16,26H,17H2,1H3,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 9.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124101
(CHEMBL3622796)Show SMILES COc1ccc(cc1)C1=NN(C(C1)c1ccc2ccccc2c1)c1ccc(cc1)S(N)(=O)=O |t:9| Show InChI InChI=1S/C26H23N3O3S/c1-32-23-12-8-19(9-13-23)25-17-26(21-7-6-18-4-2-3-5-20(18)16-21)29(28-25)22-10-14-24(15-11-22)33(27,30)31/h2-16,26H,17H2,1H3,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50124123
(CHEMBL3622219)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1cccc2ccccc12)c1ccccc1 |c:12| Show InChI InChI=1S/C25H21N3O2S/c26-31(29,30)21-15-13-20(14-16-21)28-25(17-24(27-28)19-8-2-1-3-9-19)23-12-6-10-18-7-4-5-11-22(18)23/h1-16,25H,17H2,(H2,26,29,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.09E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP9 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124128
(CHEMBL3622223)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1cccc2ccccc12)c1cccc(Br)c1 |c:12| Show InChI InChI=1S/C25H20BrN3O2S/c26-19-8-3-7-18(15-19)24-16-25(23-10-4-6-17-5-1-2-9-22(17)23)29(28-24)20-11-13-21(14-12-20)32(27,30)31/h1-15,25H,16H2,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.12E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124128
(CHEMBL3622223)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1cccc2ccccc12)c1cccc(Br)c1 |c:12| Show InChI InChI=1S/C25H20BrN3O2S/c26-19-8-3-7-18(15-19)24-16-25(23-10-4-6-17-5-1-2-9-22(17)23)29(28-24)20-11-13-21(14-12-20)32(27,30)31/h1-15,25H,16H2,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.14E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50123981
(CHEMBL3622788)Show SMILES Cc1ccccc1C1=NN(C(C1)c1ccc2ccccc2c1)c1ccc(cc1)S(N)(=O)=O |t:8| Show InChI InChI=1S/C26H23N3O2S/c1-18-6-2-5-9-24(18)25-17-26(21-11-10-19-7-3-4-8-20(19)16-21)29(28-25)22-12-14-23(15-13-22)32(27,30)31/h2-16,26H,17H2,1H3,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.14E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50123981
(CHEMBL3622788)Show SMILES Cc1ccccc1C1=NN(C(C1)c1ccc2ccccc2c1)c1ccc(cc1)S(N)(=O)=O |t:8| Show InChI InChI=1S/C26H23N3O2S/c1-18-6-2-5-9-24(18)25-17-26(21-11-10-19-7-3-4-8-20(19)16-21)29(28-25)22-12-14-23(15-13-22)32(27,30)31/h2-16,26H,17H2,1H3,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.15E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50124125
(CHEMBL3621216)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1cccc2ccccc12)c1ccccc1Cl |c:12| Show InChI InChI=1S/C25H20ClN3O2S/c26-23-11-4-3-9-22(23)24-16-25(21-10-5-7-17-6-1-2-8-20(17)21)29(28-24)18-12-14-19(15-13-18)32(27,30)31/h1-15,25H,16H2,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP9 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50123980
(CHEMBL3622787)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1ccc2ccccc2c1)c1ccccc1 |c:12| Show InChI InChI=1S/C25H21N3O2S/c26-31(29,30)23-14-12-22(13-15-23)28-25(17-24(27-28)19-7-2-1-3-8-19)21-11-10-18-6-4-5-9-20(18)16-21/h1-16,25H,17H2,(H2,26,29,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.26E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50123980
(CHEMBL3622787)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1ccc2ccccc2c1)c1ccccc1 |c:12| Show InChI InChI=1S/C25H21N3O2S/c26-31(29,30)23-14-12-22(13-15-23)28-25(17-24(27-28)19-7-2-1-3-8-19)21-11-10-18-6-4-5-9-20(18)16-21/h1-16,25H,17H2,(H2,26,29,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.26E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50124129
(CHEMBL3622224)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1cccc2ccccc12)c1cccc(I)c1 |c:12| Show InChI InChI=1S/C25H20IN3O2S/c26-19-8-3-7-18(15-19)24-16-25(23-10-4-6-17-5-1-2-9-22(17)23)29(28-24)20-11-13-21(14-12-20)32(27,30)31/h1-15,25H,16H2,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.29E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP9 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50124026
(CHEMBL3622793)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1ccc2ccccc2c1)c1cccc(Br)c1 |c:12| Show InChI InChI=1S/C25H20BrN3O2S/c26-21-7-3-6-19(15-21)24-16-25(20-9-8-17-4-1-2-5-18(17)14-20)29(28-24)22-10-12-23(13-11-22)32(27,30)31/h1-15,25H,16H2,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.39E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP9 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50123982
(CHEMBL3622789)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1ccc2ccccc2c1)c1ccccc1Cl |c:12| Show InChI InChI=1S/C25H20ClN3O2S/c26-23-8-4-3-7-22(23)24-16-25(19-10-9-17-5-1-2-6-18(17)15-19)29(28-24)20-11-13-21(14-12-20)32(27,30)31/h1-15,25H,16H2,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.48E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124102
(CHEMBL3622797)Show SMILES CCOc1ccc(cc1)C1=NN(C(C1)c1ccc2ccccc2c1)c1ccc(cc1)S(N)(=O)=O |t:10| Show InChI InChI=1S/C27H25N3O3S/c1-2-33-24-13-9-20(10-14-24)26-18-27(22-8-7-19-5-3-4-6-21(19)17-22)30(29-26)23-11-15-25(16-12-23)34(28,31)32/h3-17,27H,2,18H2,1H3,(H2,28,31,32) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.48E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50123982
(CHEMBL3622789)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1ccc2ccccc2c1)c1ccccc1Cl |c:12| Show InChI InChI=1S/C25H20ClN3O2S/c26-23-8-4-3-7-22(23)24-16-25(19-10-9-17-5-1-2-6-18(17)15-19)29(28-24)20-11-13-21(14-12-20)32(27,30)31/h1-15,25H,16H2,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.48E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124102
(CHEMBL3622797)Show SMILES CCOc1ccc(cc1)C1=NN(C(C1)c1ccc2ccccc2c1)c1ccc(cc1)S(N)(=O)=O |t:10| Show InChI InChI=1S/C27H25N3O3S/c1-2-33-24-13-9-20(10-14-24)26-18-27(22-8-7-19-5-3-4-6-21(19)17-22)30(29-26)23-11-15-25(16-12-23)34(28,31)32/h3-17,27H,2,18H2,1H3,(H2,28,31,32) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.49E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124099
(CHEMBL3622794)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1ccc2ccccc2c1)c1cccc(I)c1 |c:12| Show InChI InChI=1S/C25H20IN3O2S/c26-21-7-3-6-19(15-21)24-16-25(20-9-8-17-4-1-2-5-18(17)14-20)29(28-24)22-10-12-23(13-11-22)32(27,30)31/h1-15,25H,16H2,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.55E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124099
(CHEMBL3622794)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1ccc2ccccc2c1)c1cccc(I)c1 |c:12| Show InChI InChI=1S/C25H20IN3O2S/c26-21-7-3-6-19(15-21)24-16-25(20-9-8-17-4-1-2-5-18(17)14-20)29(28-24)22-10-12-23(13-11-22)32(27,30)31/h1-15,25H,16H2,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.57E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50124130
(CHEMBL3622225)Show SMILES Cc1ccc(cc1)C1=NN(C(C1)c1cccc2ccccc12)c1ccc(cc1)S(N)(=O)=O |t:8| Show InChI InChI=1S/C26H23N3O2S/c1-18-9-11-20(12-10-18)25-17-26(24-8-4-6-19-5-2-3-7-23(19)24)29(28-25)21-13-15-22(16-14-21)32(27,30)31/h2-16,26H,17H2,1H3,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP9 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124103
(CHEMBL3622798)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1ccc2ccccc2c1)c1ccc(F)cc1 |c:12| Show InChI InChI=1S/C25H20FN3O2S/c26-21-9-7-18(8-10-21)24-16-25(20-6-5-17-3-1-2-4-19(17)15-20)29(28-24)22-11-13-23(14-12-22)32(27,30)31/h1-15,25H,16H2,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.68E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124103
(CHEMBL3622798)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1ccc2ccccc2c1)c1ccc(F)cc1 |c:12| Show InChI InChI=1S/C25H20FN3O2S/c26-21-9-7-18(8-10-21)24-16-25(20-6-5-17-3-1-2-4-19(17)15-20)29(28-24)22-11-13-23(14-12-22)32(27,30)31/h1-15,25H,16H2,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.70E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124026
(CHEMBL3622793)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1ccc2ccccc2c1)c1cccc(Br)c1 |c:12| Show InChI InChI=1S/C25H20BrN3O2S/c26-21-7-3-6-19(15-21)24-16-25(20-9-8-17-4-1-2-5-18(17)14-20)29(28-24)22-10-12-23(13-11-22)32(27,30)31/h1-15,25H,16H2,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.78E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124026
(CHEMBL3622793)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1ccc2ccccc2c1)c1cccc(Br)c1 |c:12| Show InChI InChI=1S/C25H20BrN3O2S/c26-21-7-3-6-19(15-21)24-16-25(20-9-8-17-4-1-2-5-18(17)14-20)29(28-24)22-10-12-23(13-11-22)32(27,30)31/h1-15,25H,16H2,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.78E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50124102
(CHEMBL3622797)Show SMILES CCOc1ccc(cc1)C1=NN(C(C1)c1ccc2ccccc2c1)c1ccc(cc1)S(N)(=O)=O |t:10| Show InChI InChI=1S/C27H25N3O3S/c1-2-33-24-13-9-20(10-14-24)26-18-27(22-8-7-19-5-3-4-6-21(19)17-22)30(29-26)23-11-15-25(16-12-23)34(28,31)32/h3-17,27H,2,18H2,1H3,(H2,28,31,32) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.83E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP9 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50124101
(CHEMBL3622796)Show SMILES COc1ccc(cc1)C1=NN(C(C1)c1ccc2ccccc2c1)c1ccc(cc1)S(N)(=O)=O |t:9| Show InChI InChI=1S/C26H23N3O3S/c1-32-23-12-8-19(9-13-23)25-17-26(21-7-6-18-4-2-3-5-20(18)16-21)29(28-25)22-10-14-24(15-11-22)33(27,30)31/h2-16,26H,17H2,1H3,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.90E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP9 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50124103
(CHEMBL3622798)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1ccc2ccccc2c1)c1ccc(F)cc1 |c:12| Show InChI InChI=1S/C25H20FN3O2S/c26-21-9-7-18(8-10-21)24-16-25(20-6-5-17-3-1-2-4-19(17)15-20)29(28-24)22-11-13-23(14-12-22)32(27,30)31/h1-15,25H,16H2,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.98E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP9 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124011
(CHEMBL3622792)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1ccc2ccccc2c1)c1cccc(F)c1 |c:12| Show InChI InChI=1S/C25H20FN3O2S/c26-21-7-3-6-19(15-21)24-16-25(20-9-8-17-4-1-2-5-18(17)14-20)29(28-24)22-10-12-23(13-11-22)32(27,30)31/h1-15,25H,16H2,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.38E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50124011
(CHEMBL3622792)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1ccc2ccccc2c1)c1cccc(F)c1 |c:12| Show InChI InChI=1S/C25H20FN3O2S/c26-21-7-3-6-19(15-21)24-16-25(20-9-8-17-4-1-2-5-18(17)14-20)29(28-24)22-10-12-23(13-11-22)32(27,30)31/h1-15,25H,16H2,(H2,27,30,31) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.40E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP2 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
Matrix metalloproteinase-9
(Homo sapiens (Human)) | BDBM50123980
(CHEMBL3622787)Show SMILES NS(=O)(=O)c1ccc(cc1)N1N=C(CC1c1ccc2ccccc2c1)c1ccccc1 |c:12| Show InChI InChI=1S/C25H21N3O2S/c26-31(29,30)23-14-12-22(13-15-23)28-25(17-24(27-28)19-7-2-1-3-8-19)21-11-10-18-6-4-5-9-20(18)16-21/h1-16,25H,17H2,(H2,26,29,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.38E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Nanjing University
Curated by ChEMBL
| Assay Description
Inhibition of APMA-activated human recombinant MMP9 incubated for 5 mins using 4-nitrophenylacetate substrate by esterase assay |
Bioorg Med Chem Lett 25: 4664-71 (2015)
Article DOI: 10.1016/j.bmcl.2015.08.026
BindingDB Entry DOI: 10.7270/Q2RN39NC |
More data for this
Ligand-Target Pair | |
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