Found 20 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)) | BDBM50247539
(CHEMBL472915 | N-((3S,5S)-1-((E)-3-(3,4-dimethoxyp...)Show SMILES COc1ccc(\C=C\C(=O)N2C[C@H](C[C@H]2C(=O)NO)NC(=O)c2cccnc2)cc1OC |r| Show InChI InChI=1S/C22H24N4O6/c1-31-18-7-5-14(10-19(18)32-2)6-8-20(27)26-13-16(11-17(26)22(29)25-30)24-21(28)15-4-3-9-23-12-15/h3-10,12,16-17,30H,11,13H2,1-2H3,(H,24,28)(H,25,29)/b8-6+/t16-,17-/m0/s1 | 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 | 5.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 |
Bioorg Med Chem 18: 1516-25 (2010)
Article DOI: 10.1016/j.bmc.2010.01.008
BindingDB Entry DOI: 10.7270/Q2765FDH |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50306914
((S)-2-(2-(3-Methyl-2-oxoquinoxalin-1(2H)-yl)acetam...)Show SMILES Cc1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)Cn2c3ccccc3nc(C)c2=O)cc1 |r| Show InChI InChI=1S/C27H26N4O3/c1-18-12-14-21(15-13-18)29-26(33)23(16-20-8-4-3-5-9-20)30-25(32)17-31-24-11-7-6-10-22(24)28-19(2)27(31)34/h3-15,23H,16-17H2,1-2H3,(H,29,33)(H,30,32)/t23-/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 | 1.05E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 |
Bioorg Med Chem 18: 1516-25 (2010)
Article DOI: 10.1016/j.bmc.2010.01.008
BindingDB Entry DOI: 10.7270/Q2765FDH |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50306920
((S)-N-(3,4-Difluorophenyl)-2-(3-methyl-2-oxoquinox...)Show SMILES Cc1nc2ccccc2n(CC(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccc(F)c(F)c2)c1=O |r| Show InChI InChI=1S/C26H22F2N4O3/c1-16-26(35)32(23-10-6-5-9-21(23)29-16)15-24(33)31-22(13-17-7-3-2-4-8-17)25(34)30-18-11-12-19(27)20(28)14-18/h2-12,14,22H,13,15H2,1H3,(H,30,34)(H,31,33)/t22-/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 | 2.42E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 |
Bioorg Med Chem 18: 1516-25 (2010)
Article DOI: 10.1016/j.bmc.2010.01.008
BindingDB Entry DOI: 10.7270/Q2765FDH |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50306921
((S)-N-(3,4-Dichlorophenyl)-2-(3-methyl-2-oxoquinox...)Show SMILES Cc1nc2ccccc2n(CC(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccc(Cl)c(Cl)c2)c1=O |r| Show InChI InChI=1S/C26H22Cl2N4O3/c1-16-26(35)32(23-10-6-5-9-21(23)29-16)15-24(33)31-22(13-17-7-3-2-4-8-17)25(34)30-18-11-12-19(27)20(28)14-18/h2-12,14,22H,13,15H2,1H3,(H,30,34)(H,31,33)/t22-/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 | 2.62E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 |
Bioorg Med Chem 18: 1516-25 (2010)
Article DOI: 10.1016/j.bmc.2010.01.008
BindingDB Entry DOI: 10.7270/Q2765FDH |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50306913
((S)-2-(2-(3-Methyl-2-oxoquinoxalin-1(2H)-yl)acetam...)Show SMILES Cc1nc2ccccc2n(CC(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2cccnc2)c1=O |r| Show InChI InChI=1S/C25H23N5O3/c1-17-25(33)30(22-12-6-5-11-20(22)27-17)16-23(31)29-21(14-18-8-3-2-4-9-18)24(32)28-19-10-7-13-26-15-19/h2-13,15,21H,14,16H2,1H3,(H,28,32)(H,29,31)/t21-/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 | 3.01E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 |
Bioorg Med Chem 18: 1516-25 (2010)
Article DOI: 10.1016/j.bmc.2010.01.008
BindingDB Entry DOI: 10.7270/Q2765FDH |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50306915
((S)-2-(2-(3-Methyl-2-oxoquinoxalin-1(2H)-yl)acetam...)Show SMILES Cc1ccccc1NC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1c2ccccc2nc(C)c1=O |r| Show InChI InChI=1S/C27H26N4O3/c1-18-10-6-7-13-21(18)30-26(33)23(16-20-11-4-3-5-12-20)29-25(32)17-31-24-15-9-8-14-22(24)28-19(2)27(31)34/h3-15,23H,16-17H2,1-2H3,(H,29,32)(H,30,33)/t23-/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 | 3.73E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 |
Bioorg Med Chem 18: 1516-25 (2010)
Article DOI: 10.1016/j.bmc.2010.01.008
BindingDB Entry DOI: 10.7270/Q2765FDH |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50306923
((S)-2-(2-(3-Methyl-2-oxoquinoxalin-1(2H)-yl)acetam...)Show SMILES CCCNC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1c2ccccc2nc(C)c1=O |r| Show InChI InChI=1S/C23H26N4O3/c1-3-13-24-22(29)19(14-17-9-5-4-6-10-17)26-21(28)15-27-20-12-8-7-11-18(20)25-16(2)23(27)30/h4-12,19H,3,13-15H2,1-2H3,(H,24,29)(H,26,28)/t19-/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 | 5.66E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 |
Bioorg Med Chem 18: 1516-25 (2010)
Article DOI: 10.1016/j.bmc.2010.01.008
BindingDB Entry DOI: 10.7270/Q2765FDH |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50306912
((S)-2-(2-(3-Methyl-2-oxoquinoxalin-1(2H)-yl)acetam...)Show SMILES Cc1nc2ccccc2n(CC(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccccc2)c1=O |r| Show InChI InChI=1S/C26H24N4O3/c1-18-26(33)30(23-15-9-8-14-21(23)27-18)17-24(31)29-22(16-19-10-4-2-5-11-19)25(32)28-20-12-6-3-7-13-20/h2-15,22H,16-17H2,1H3,(H,28,32)(H,29,31)/t22-/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 | 5.81E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 |
Bioorg Med Chem 18: 1516-25 (2010)
Article DOI: 10.1016/j.bmc.2010.01.008
BindingDB Entry DOI: 10.7270/Q2765FDH |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50306925
((S)-N,N-Diethyl-2-(2-(3-methyl-2-oxoquinoxalin-1(2...)Show SMILES CCN(CC)C(=O)[C@H](Cc1ccccc1)NC(=O)Cn1c2ccccc2nc(C)c1=O |r| Show InChI InChI=1S/C24H28N4O3/c1-4-27(5-2)24(31)20(15-18-11-7-6-8-12-18)26-22(29)16-28-21-14-10-9-13-19(21)25-17(3)23(28)30/h6-14,20H,4-5,15-16H2,1-3H3,(H,26,29)/t20-/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 | 1.05E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 |
Bioorg Med Chem 18: 1516-25 (2010)
Article DOI: 10.1016/j.bmc.2010.01.008
BindingDB Entry DOI: 10.7270/Q2765FDH |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50306924
((S)-N-Butyl-2-(2-(3-methyl-2-oxoquinoxalin-1(2H)-y...)Show SMILES CCCCNC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1c2ccccc2nc(C)c1=O |r| Show InChI InChI=1S/C24H28N4O3/c1-3-4-14-25-23(30)20(15-18-10-6-5-7-11-18)27-22(29)16-28-21-13-9-8-12-19(21)26-17(2)24(28)31/h5-13,20H,3-4,14-16H2,1-2H3,(H,25,30)(H,27,29)/t20-/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 | 1.06E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 |
Bioorg Med Chem 18: 1516-25 (2010)
Article DOI: 10.1016/j.bmc.2010.01.008
BindingDB Entry DOI: 10.7270/Q2765FDH |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50306917
((S)-N-(4-Fluorophenyl)-2-(3-methyl-2-oxoquinoxalin...)Show SMILES Cc1nc2ccccc2n(CC(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccc(F)cc2)c1=O |r| Show InChI InChI=1S/C26H23FN4O3/c1-17-26(34)31(23-10-6-5-9-21(23)28-17)16-24(32)30-22(15-18-7-3-2-4-8-18)25(33)29-20-13-11-19(27)12-14-20/h2-14,22H,15-16H2,1H3,(H,29,33)(H,30,32)/t22-/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 | 1.24E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 |
Bioorg Med Chem 18: 1516-25 (2010)
Article DOI: 10.1016/j.bmc.2010.01.008
BindingDB Entry DOI: 10.7270/Q2765FDH |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50306918
((S)-N-(4-Chlorophenyl)-2-(3-methyl-2-oxoquinoxalin...)Show SMILES Cc1nc2ccccc2n(CC(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccc(Cl)cc2)c1=O |r| Show InChI InChI=1S/C26H23ClN4O3/c1-17-26(34)31(23-10-6-5-9-21(23)28-17)16-24(32)30-22(15-18-7-3-2-4-8-18)25(33)29-20-13-11-19(27)12-14-20/h2-14,22H,15-16H2,1H3,(H,29,33)(H,30,32)/t22-/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 | 6.24E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 |
Bioorg Med Chem 18: 1516-25 (2010)
Article DOI: 10.1016/j.bmc.2010.01.008
BindingDB Entry DOI: 10.7270/Q2765FDH |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50306922
((S)-N-(3-Chloro-4-fluorophenyl)-2-(3-methyl-2-oxoq...)Show SMILES Cc1nc2ccccc2n(CC(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccc(F)c(Cl)c2)c1=O |r| Show InChI InChI=1S/C26H22ClFN4O3/c1-16-26(35)32(23-10-6-5-9-21(23)29-16)15-24(33)31-22(13-17-7-3-2-4-8-17)25(34)30-18-11-12-20(28)19(27)14-18/h2-12,14,22H,13,15H2,1H3,(H,30,34)(H,31,33)/t22-/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 | 1.36E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 |
Bioorg Med Chem 18: 1516-25 (2010)
Article DOI: 10.1016/j.bmc.2010.01.008
BindingDB Entry DOI: 10.7270/Q2765FDH |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50306927
((R)-Methyl4-methyl-2-((S)-2-(2-(3-methyl-2-oxoquin...)Show SMILES COC(=O)C(CC(C)C)NC(=O)[C@@H](Cc1ccccc1)NC(=O)Cn1c2ccccc2nc(C)c1=O |r| Show InChI InChI=1S/C27H32N4O5/c1-17(2)14-22(27(35)36-4)30-25(33)21(15-19-10-6-5-7-11-19)29-24(32)16-31-23-13-9-8-12-20(23)28-18(3)26(31)34/h5-13,17,21-22H,14-16H2,1-4H3,(H,29,32)(H,30,33)/t21-,22?/m1/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 | 1.75E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 |
Bioorg Med Chem 18: 1516-25 (2010)
Article DOI: 10.1016/j.bmc.2010.01.008
BindingDB Entry DOI: 10.7270/Q2765FDH |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50306930
(CHEMBL600619 | Methyl 4-((S)-2-(2-(3-methyl-2-oxoq...)Show SMILES COC(=O)CCC(NC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1c2ccccc2nc(C)c1=O)SC |r| Show InChI InChI=1S/C26H30N4O5S/c1-17-26(34)30(21-12-8-7-11-19(21)27-17)16-22(31)28-20(15-18-9-5-4-6-10-18)25(33)29-23(36-3)13-14-24(32)35-2/h4-12,20,23H,13-16H2,1-3H3,(H,28,31)(H,29,33)/t20-,23?/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 | 1.92E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 |
Bioorg Med Chem 18: 1516-25 (2010)
Article DOI: 10.1016/j.bmc.2010.01.008
BindingDB Entry DOI: 10.7270/Q2765FDH |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50306919
((S)-N-(4-Bromophenyl)-2-(3-methyl-2-oxoquinoxalin-...)Show SMILES Cc1nc2ccccc2n(CC(=O)N[C@@H](Cc2ccccc2)C(=O)Nc2ccc(Br)cc2)c1=O |r| Show InChI InChI=1S/C26H23BrN4O3/c1-17-26(34)31(23-10-6-5-9-21(23)28-17)16-24(32)30-22(15-18-7-3-2-4-8-18)25(33)29-20-13-11-19(27)12-14-20/h2-14,22H,15-16H2,1H3,(H,29,33)(H,30,32)/t22-/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 | 2.00E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 |
Bioorg Med Chem 18: 1516-25 (2010)
Article DOI: 10.1016/j.bmc.2010.01.008
BindingDB Entry DOI: 10.7270/Q2765FDH |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50306928
((S)-Methyl 4-(2-(2-(3-methyl-2-oxoquinoxalin-1(2H)...)Show SMILES COC(=O)CCCNC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1c2ccccc2nc(C)c1=O |r| Show InChI InChI=1S/C25H28N4O5/c1-17-25(33)29(21-12-7-6-11-19(21)27-17)16-22(30)28-20(15-18-9-4-3-5-10-18)24(32)26-14-8-13-23(31)34-2/h3-7,9-12,20H,8,13-16H2,1-2H3,(H,26,32)(H,28,30)/t20-/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 | 2.76E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 |
Bioorg Med Chem 18: 1516-25 (2010)
Article DOI: 10.1016/j.bmc.2010.01.008
BindingDB Entry DOI: 10.7270/Q2765FDH |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50306916
((S)-2-(2-(3-Methyl-2-oxoquinoxalin-1(2H)-yl)acetam...)Show SMILES Cc1cccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)Cn2c3ccccc3nc(C)c2=O)c1 |r| Show InChI InChI=1S/C27H26N4O3/c1-18-9-8-12-21(15-18)29-26(33)23(16-20-10-4-3-5-11-20)30-25(32)17-31-24-14-7-6-13-22(24)28-19(2)27(31)34/h3-15,23H,16-17H2,1-2H3,(H,29,33)(H,30,32)/t23-/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 | 6.46E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 |
Bioorg Med Chem 18: 1516-25 (2010)
Article DOI: 10.1016/j.bmc.2010.01.008
BindingDB Entry DOI: 10.7270/Q2765FDH |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50306926
((S)-N-Isopropyl-2-(2-(3-methyl-2-oxoquinoxalin-1(2...)Show SMILES CC(C)NC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1c2ccccc2nc(C)c1=O |r| Show InChI InChI=1S/C23H26N4O3/c1-15(2)24-22(29)19(13-17-9-5-4-6-10-17)26-21(28)14-27-20-12-8-7-11-18(20)25-16(3)23(27)30/h4-12,15,19H,13-14H2,1-3H3,(H,24,29)(H,26,28)/t19-/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 | 9.43E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 |
Bioorg Med Chem 18: 1516-25 (2010)
Article DOI: 10.1016/j.bmc.2010.01.008
BindingDB Entry DOI: 10.7270/Q2765FDH |
More data for this
Ligand-Target Pair | |
72 kDa type IV collagenase
(Homo sapiens (Human)) | BDBM50306929
((S)-Methyl 6-(2-(2-(3-methyl-2-oxoquinoxalin-1(2H)...)Show SMILES COC(=O)CCCCCNC(=O)[C@H](Cc1ccccc1)NC(=O)Cn1c2ccccc2nc(C)c1=O |r| Show InChI InChI=1S/C27H32N4O5/c1-19-27(35)31(23-14-9-8-13-21(23)29-19)18-24(32)30-22(17-20-11-5-3-6-12-20)26(34)28-16-10-4-7-15-25(33)36-2/h3,5-6,8-9,11-14,22H,4,7,10,15-18H2,1-2H3,(H,28,34)(H,30,32)/t22-/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 | 1.15E+7 | n/a | n/a | n/a | n/a | n/a | n/a |
Shandong University
Curated by ChEMBL
| Assay Description
Inhibition of MMP2 |
Bioorg Med Chem 18: 1516-25 (2010)
Article DOI: 10.1016/j.bmc.2010.01.008
BindingDB Entry DOI: 10.7270/Q2765FDH |
More data for this
Ligand-Target Pair | |
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